N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-2-keto-1H-quinoline-4-carboxamide Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=O)NC3=CC=CC=C32)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=O)NC3=CC=CC=C32)[N+](=O)[O-])OC

InChI

InChI=1S/C20H19N3O6/c1-28-17-9-12(16(23(26)27)11-18(17)29-2)7-8-21-20(25)14-10-19(24)22-15-6-4-3-5-13(14)15/h3-6,9-11H,7-8H2,1-2H3,(H,21,25)(H,22,24)