cyclohexyl 2-ethyl-2-[4-[(4-methylphenyl)amino]piperidin-1-yl]heptanoate

Systemtic Name: cyclohexyl 2-ethyl-2-[4-[(4-methylphenyl)amino]piperidin-1-yl]heptanoate Openeye Name: cyclohexyl 2-ethyl-2-[4-(4-methylanilino)-1-piperidyl]heptanoate CAS Name: 2-ethyl-2-[4-(4-methylanilino)-1-piperidinyl]heptanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-ethyl-2-[4-(4-methylanilino)piperidin-1-yl]heptanoate Traditional Name: 2-ethyl-2-[4-(p-toluidino)piperidino]enanthic acid cyclohexyl ester Formula: C27H44N2O2 MolecularWeight: 428.65046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)(C(=O)OC1CCCCC1)N2CCC(CC2)NC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCC(CC)(C(=O)OC1CCCCC1)N2CCC(CC2)NC3=CC=C(C=C3)C

InChI

InChI=1S/C27H44N2O2/c1-4-6-10-19-27(5-2,26(30)31-25-11-8-7-9-12-25)29-20-17-24(18-21-29)28-23-15-13-22(3)14-16-23/h13-16,24-25,28H,4-12,17-21H2,1-3H3