N-[2-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[3-(1H-benzimidazol-2-yl)-1-piperidyl]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[3-(1H-benzimidazol-2-yl)-1-piperidinyl]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[3-(1H-benzimidazol-2-yl)piperidino]-2-keto-ethyl]-3-nitro-benzamide Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CC(CN(C1)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H21N5O4/c27-19(12-22-21(28)14-5-3-7-16(11-14)26(29)30)25-10-4-6-15(13-25)20-23-17-8-1-2-9-18(17)24-20/h1-3,5,7-9,11,15H,4,6,10,12-13H2,(H,22,28)(H,23,24)