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Home > Quinoline > 940242-19-3
940242-19-3 | N-benzyl-5-(hydroxyimino)-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
CAS No: 940242-19-3 Catalog No: AG019KOL MDL No:MFCD09388773
Product Description
Catalog Number:
AG019KOL
Chemical Name:
N-benzyl-5-(hydroxyimino)-2-oxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
CAS Number:
940242-19-3
Molecular Formula:
C17H17N3O3
Molecular Weight:
311.3352
MDL Number:
MFCD09388773
IUPAC Name:
N-benzyl-5-hydroxyimino-2-oxo-1,6,7,8-tetrahydroquinoline-3-carboxamide
InChI:
InChI=1S/C17H17N3O3/c21-16(18-10-11-5-2-1-3-6-11)13-9-12-14(19-17(13)22)7-4-8-15(12)20-23/h1-3,5-6,9,23H,4,7-8,10H2,(H,18,21)(H,19,22)
InChI Key:
KZLFHFDODGOXMM-UHFFFAOYSA-N
SMILES:
ON=C1CCCc2c1cc(C(=O)NCc1ccccc1)c(=O)[nH]2
Properties
Complexity:
598
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.127g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
311.341g/mol
Monoisotopic Mass:
311.127g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
90.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.8
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