1-[[4-[[(2-oxidanylidene-3-propan-2-yl-1,4-dihydrobenzimidazol-3a-yl)carbonylamino]methyl]piperidin-1-yl]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[[4-[[(2-oxidanylidene-3-propan-2-yl-1,4-dihydrobenzimidazol-3a-yl)carbonylamino]methyl]piperidin-1-yl]methyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[[4-[[(3-isopropyl-2-oxo-1,4-dihydrobenzimidazole-3a-carbonyl)amino]methyl]-1-piperidyl]methyl]cyclohexanecarboxylic acid CAS Name: 1-[[4-[[[oxo-(2-oxo-3-propan-2-yl-1,4-dihydrobenzimidazol-3a-yl)methyl]amino]methyl]-1-piperidinyl]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[4-[[(2-oxo-3-propan-2-yl-1,4-dihydrobenzimidazole-3a-carbonyl)amino]methyl]piperidin-1-yl]methyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[[4-[[(3-isopropyl-2-keto-1,4-dihydrobenzimidazole-3a-carbonyl)amino]methyl]piperidino]methyl]cyclohexanecarboxylic acid Formula: C25H38N4O4 MolecularWeight: 458.59362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)NC2=CC=CCC21C(=O)NCC3CCN(CC3)CC4(CCCCC4)C(=O)O

Isomeric SMILES

CC(C)N1C(=O)NC2=CC=CCC21C(=O)NCC3CCN(CC3)CC4(CCCCC4)C(=O)O

InChI

InChI=1S/C25H38N4O4/c1-18(2)29-23(33)27-20-8-4-7-13-25(20,29)21(30)26-16-19-9-14-28(15-10-19)17-24(22(31)32)11-5-3-6-12-24/h4,7-8,18-19H,3,5-6,9-17H2,1-2H3,(H,26,30)(H,27,33)(H,31,32)