3-methyl-N-[(2S)-1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]benzamide

Systemtic Name: 3-methyl-N-[(2S)-1-[(3-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 3-methyl-N-[(1S)-1-methyl-2-(3-nitroanilino)-2-oxo-ethyl]benzamide CAS Name: 3-methyl-N-[(2S)-1-(3-nitroanilino)-1-oxopropan-2-yl]benzamide IUPAC Name: 3-methyl-N-[(2S)-1-(3-nitroanilino)-1-oxopropan-2-yl]benzamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(3-nitroanilino)ethyl]-3-methyl-benzamide Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O4/c1-11-5-3-6-13(9-11)17(22)18-12(2)16(21)19-14-7-4-8-15(10-14)20(23)24/h3-10,12H,1-2H3,(H,18,22)(H,19,21)/t12-/m0/s1