[1-(1-phenylcyclohexyl)piperidin-4-yl] 3,4-dimethoxybenzoate

Systemtic Name: [1-(1-phenylcyclohexyl)piperidin-4-yl] 3,4-dimethoxybenzoate Openeye Name: [1-(1-phenylcyclohexyl)-4-piperidyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [1-(1-phenylcyclohexyl)-4-piperidinyl] ester IUPAC Name: [1-(1-phenylcyclohexyl)piperidin-4-yl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [1-(1-phenylcyclohexyl)-4-piperidyl] ester Formula: C26H33NO4 MolecularWeight: 423.54452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC2CCN(CC2)C3(CCCCC3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC2CCN(CC2)C3(CCCCC3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H33NO4/c1-29-23-12-11-20(19-24(23)30-2)25(28)31-22-13-17-27(18-14-22)26(15-7-4-8-16-26)21-9-5-3-6-10-21/h3,5-6,9-12,19,22H,4,7-8,13-18H2,1-2H3