4-methyl-N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-[4-[2-(methylamino)-2-oxidanylidene-ethyl]phenyl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[4-[2-(methylamino)-2-oxo-ethyl]phenyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-3-nitrobenzamide Traditional Name: N-[4-[2-keto-2-(methylamino)ethyl]phenyl]-4-methyl-3-nitro-benzamide Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O4/c1-11-3-6-13(10-15(11)20(23)24)17(22)19-14-7-4-12(5-8-14)9-16(21)18-2/h3-8,10H,9H2,1-2H3,(H,18,21)(H,19,22)