6-cyano-6-(3-methylphenyl)-N-(2-nitrophenyl)-5-oxidanylidene-hexanamide

Systemtic Name: 6-cyano-6-(3-methylphenyl)-N-(2-nitrophenyl)-5-oxidanylidene-hexanamide Openeye Name: 6-cyano-6-(m-tolyl)-N-(2-nitrophenyl)-5-oxo-hexanamide CAS Name: 6-cyano-6-(3-methylphenyl)-N-(2-nitrophenyl)-5-oxohexanamide IUPAC Name: 6-cyano-6-(3-methylphenyl)-N-(2-nitrophenyl)-5-oxohexanamide Traditional Name: 6-cyano-5-keto-6-(m-tolyl)-N-(2-nitrophenyl)hexanamide Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C#N)C(=O)CCCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)C(C#N)C(=O)CCCC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O4/c1-14-6-4-7-15(12-14)16(13-21)19(24)10-5-11-20(25)22-17-8-2-3-9-18(17)23(26)27/h2-4,6-9,12,16H,5,10-11H2,1H3,(H,22,25)