N-[2-[3-(2-methylbenzimidazol-1-yl)propylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[3-(2-methylbenzimidazol-1-yl)propylamino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[3-(2-methylbenzimidazol-1-yl)propylamino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[3-(2-methyl-1-benzimidazolyl)propylamino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[3-(2-methylbenzimidazol-1-yl)propylamino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[3-(2-methylbenzimidazol-1-yl)propylamino]ethyl]-3-nitro-benzamide Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CCCNC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CCCNC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O4/c1-14-23-17-8-2-3-9-18(17)24(14)11-5-10-21-19(26)13-22-20(27)15-6-4-7-16(12-15)25(28)29/h2-4,6-9,12H,5,10-11,13H2,1H3,(H,21,26)(H,22,27)