N-[[ethanoyl-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]amino]methyl]-4-nitro-benzamide

Systemtic Name: N-[[ethanoyl-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]amino]methyl]-4-nitro-benzamide Openeye Name: N-[[acetyl-[2-(benzylamino)-2-oxo-ethyl]amino]methyl]-4-nitro-benzamide CAS Name: N-[[acetyl-[2-oxo-2-[(phenylmethyl)amino]ethyl]amino]methyl]-4-nitrobenzamide IUPAC Name: N-[[acetyl-[2-(benzylamino)-2-oxoethyl]amino]methyl]-4-nitrobenzamide Traditional Name: N-[[acetyl-[2-(benzylamino)-2-keto-ethyl]amino]methyl]-4-nitro-benzamide Formula: C19H20N4O5 MolecularWeight: 384.3859

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N4O5/c1-14(24)22(12-18(25)20-11-15-5-3-2-4-6-15)13-21-19(26)16-7-9-17(10-8-16)23(27)28/h2-10H,11-13H2,1H3,(H,20,25)(H,21,26)