N-[2-[3-[methyl-(phenylmethyl)amino]propylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[3-[methyl-(phenylmethyl)amino]propylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[3-[benzyl(methyl)amino]propylamino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[3-[methyl-(phenylmethyl)amino]propylamino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[3-[benzyl(methyl)amino]propylamino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[3-[benzyl(methyl)amino]propylamino]-2-keto-ethyl]-3-nitro-benzamide Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

CN(CCCNC(=O)CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C20H24N4O4/c1-23(15-16-7-3-2-4-8-16)12-6-11-21-19(25)14-22-20(26)17-9-5-10-18(13-17)24(27)28/h2-5,7-10,13H,6,11-12,14-15H2,1H3,(H,21,25)(H,22,26)