N-[1-[4-(hydroxymethyl)cyclohexyl]-4-methyl-5-piperidin-1-yl-benzimidazol-2-yl]-3-nitro-benzamide

Systemtic Name: N-[1-[4-(hydroxymethyl)cyclohexyl]-4-methyl-5-piperidin-1-yl-benzimidazol-2-yl]-3-nitro-benzamide Openeye Name: N-[1-[4-(hydroxymethyl)cyclohexyl]-4-methyl-5-(1-piperidyl)benzimidazol-2-yl]-3-nitro-benzamide CAS Name: N-[1-[4-(hydroxymethyl)cyclohexyl]-4-methyl-5-(1-piperidinyl)-2-benzimidazolyl]-3-nitrobenzamide IUPAC Name: N-[1-[4-(hydroxymethyl)cyclohexyl]-4-methyl-5-piperidin-1-ylbenzimidazol-2-yl]-3-nitrobenzamide Traditional Name: N-[4-methyl-1-(4-methylolcyclohexyl)-5-piperidino-benzimidazol-2-yl]-3-nitro-benzamide Formula: C27H33N5O4 MolecularWeight: 491.58202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(N2C3CCC(CC3)CO)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])N5CCCCC5

Isomeric SMILES

CC1=C(C=CC2=C1N=C(N2C3CCC(CC3)CO)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-])N5CCCCC5

InChI

InChI=1S/C27H33N5O4/c1-18-23(30-14-3-2-4-15-30)12-13-24-25(18)28-27(31(24)21-10-8-19(17-33)9-11-21)29-26(34)20-6-5-7-22(16-20)32(35)36/h5-7,12-13,16,19,21,33H,2-4,8-11,14-15,17H2,1H3,(H,28,29,34)