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

Systemtic Name: 3-methyl-N-[(2S)-1-[2-[(2-nitrophenyl)amino]ethylamino]-1-oxidanylidene-propan-2-yl]benzamide Openeye Name: 3-methyl-N-[(1S)-1-methyl-2-[2-(2-nitroanilino)ethylamino]-2-oxo-ethyl]benzamide CAS Name: 3-methyl-N-[(2S)-1-[2-(2-nitroanilino)ethylamino]-1-oxopropan-2-yl]benzamide IUPAC Name: 3-methyl-N-[(2S)-1-[2-(2-nitroanilino)ethylamino]-1-oxopropan-2-yl]benzamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-[2-(2-nitroanilino)ethylamino]ethyl]-3-methyl-benzamide Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C)C(=O)NCCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](C)C(=O)NCCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-13-6-5-7-15(12-13)19(25)22-14(2)18(24)21-11-10-20-16-8-3-4-9-17(16)23(26)27/h3-9,12,14,20H,10-11H2,1-2H3,(H,21,24)(H,22,25)/t14-/m0/s1