methyl 1-[1-(1-phenylcycloheptyl)piperidin-4-yl]benzimidazole-2-carboxylate

Systemtic Name: methyl 1-[1-(1-phenylcycloheptyl)piperidin-4-yl]benzimidazole-2-carboxylate Openeye Name: methyl 1-[1-(1-phenylcycloheptyl)-4-piperidyl]benzimidazole-2-carboxylate CAS Name: 1-[1-(1-phenylcycloheptyl)-4-piperidinyl]-2-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-(1-phenylcycloheptyl)piperidin-4-yl]benzimidazole-2-carboxylate Traditional Name: 1-[1-(1-phenylcycloheptyl)-4-piperidyl]benzimidazole-2-carboxylic acid methyl ester Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC2=CC=CC=C2N1C3CCN(CC3)C4(CCCCCC4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=NC2=CC=CC=C2N1C3CCN(CC3)C4(CCCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H33N3O2/c1-32-26(31)25-28-23-13-7-8-14-24(23)30(25)22-15-19-29(20-16-22)27(17-9-2-3-10-18-27)21-11-5-4-6-12-21/h4-8,11-14,22H,2-3,9-10,15-20H2,1H3