N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1S)-2-[(4-dimethylaminophenyl)methylamino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2S)-1-[(4-dimethylaminophenyl)methylamino]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1S)-2-[[4-(dimethylamino)benzyl]amino]-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)N(C)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=C(C=C1)N(C)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-13(21-19(25)15-5-4-6-17(11-15)23(26)27)18(24)20-12-14-7-9-16(10-8-14)22(2)3/h4-11,13H,12H2,1-3H3,(H,20,24)(H,21,25)/t13-/m0/s1