methyl 4-[[1-(4-cyanophenyl)piperidin-4-yl]carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[[1-(4-cyanophenyl)piperidin-4-yl]carbamoyl]cyclohexane-1-carboxylate Openeye Name: methyl 4-[[1-(4-cyanophenyl)-4-piperidyl]carbamoyl]cyclohexanecarboxylate CAS Name: 4-[[[1-(4-cyanophenyl)-4-piperidinyl]amino]-oxomethyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[[1-(4-cyanophenyl)piperidin-4-yl]carbamoyl]cyclohexane-1-carboxylate Traditional Name: 4-[[1-(4-cyanophenyl)-4-piperidyl]carbamoyl]cyclohexanecarboxylic acid methyl ester Formula: C21H27N3O3 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)C(=O)NC2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)C1CCC(CC1)C(=O)NC2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H27N3O3/c1-27-21(26)17-6-4-16(5-7-17)20(25)23-18-10-12-24(13-11-18)19-8-2-15(14-22)3-9-19/h2-3,8-9,16-18H,4-7,10-13H2,1H3,(H,23,25)