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Home > Indoles and Oxindole > 886499-34-9
886499-34-9 | 2-(3-Formyl-indol-1-yl)-N-(2-methoxy-5-nitro-phenyl)-acetamide
CAS No: 886499-34-9 Catalog No: AG01EYDJ MDL No:
Product Description
Catalog Number:
AG01EYDJ
Chemical Name:
2-(3-Formyl-indol-1-yl)-N-(2-methoxy-5-nitro-phenyl)-acetamide
CAS Number:
886499-34-9
Molecular Formula:
C18H15N3O5
Molecular Weight:
353.3288
IUPAC Name:
2-(3-formylindol-1-yl)-N-(2-methoxy-5-nitrophenyl)acetamide
InChI:
InChI=1S/C18H15N3O5/c1-26-17-7-6-13(21(24)25)8-15(17)19-18(23)10-20-9-12(11-22)14-4-2-3-5-16(14)20/h2-9,11H,10H2,1H3,(H,19,23)
InChI Key:
BVQUYMRQAQTICK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1NC(=O)Cn1cc(c2c1cccc2)C=O)[N+](=O)[O-]
Properties
Complexity:
537
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.101g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
353.334g/mol
Monoisotopic Mass:
353.101g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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