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

Systemtic Name: N-[3-[(4-cyanophenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(4-cyanoanilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-(4-cyanoanilino)-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(4-cyanoanilino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-(4-cyanoanilino)-3-keto-propyl]-4-nitro-benzamide Formula: C17H14N4O4 MolecularWeight: 338.31746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C#N)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O4/c18-11-12-1-5-14(6-2-12)20-16(22)9-10-19-17(23)13-3-7-15(8-4-13)21(24)25/h1-8H,9-10H2,(H,19,23)(H,20,22)