3-nitro-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-4-[(phenylmethyl)amino]benzamide

Systemtic Name: 3-nitro-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]-4-[(phenylmethyl)amino]benzamide Openeye Name: 4-(benzylamino)-N-[2-(isopropylamino)-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 3-nitro-N-[2-oxo-2-(propan-2-ylamino)ethyl]-4-[(phenylmethyl)amino]benzamide IUPAC Name: 4-(benzylamino)-3-nitro-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide Traditional Name: 4-(benzylamino)-N-[2-(isopropylamino)-2-keto-ethyl]-3-nitro-benzamide Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)CNC(=O)C1=CC(=C(C=C1)NCC2=CC=CC=C2)[N+](=O)[O-]

InChI

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