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Home > Imidazoles > 76918-62-2
76918-62-2 | 2-Naphthalenecarboxamide,N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-hydroxy-, sodium salt (1:1)
CAS No: 76918-62-2 Catalog No: AG005RSL MDL No:
Product Description
Catalog Number:
AG005RSL
Chemical Name:
2-Naphthalenecarboxamide,N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-3-hydroxy-, sodium salt (1:1)
CAS Number:
76918-62-2
Molecular Formula:
C18H13N3NaO3
Molecular Weight:
342.3039
IUPAC Name:
3-hydroxy-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)naphthalene-2-carboxamide;sodium
InChI:
InChI=1S/C18H13N3O3.Na/c22-16-8-11-4-2-1-3-10(11)7-13(16)17(23)19-12-5-6-14-15(9-12)21-18(24)20-14;/h1-9,22H,(H,19,23)(H2,20,21,24);
InChI Key:
QICDDGZXMXMTHO-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2c([nH]1)ccc(c2)NC(=O)c1cc2ccccc2cc1O.[Na]
EC Number:
278-575-4
Properties
Complexity:
512
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.085g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
342.31g/mol
Monoisotopic Mass:
342.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
90.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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