N-[3-[(3,4-dimethoxyphenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(3,4-dimethoxyphenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(3,4-dimethoxyanilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-(3,4-dimethoxyanilino)-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(3,4-dimethoxyanilino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-(3,4-dimethoxyanilino)-3-keto-propyl]-4-nitro-benzamide Formula: C18H19N3O6 MolecularWeight: 373.35996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O6/c1-26-15-8-5-13(11-16(15)27-2)20-17(22)9-10-19-18(23)12-3-6-14(7-4-12)21(24)25/h3-8,11H,9-10H2,1-2H3,(H,19,23)(H,20,22)