methyl 1-(3-methoxyphenyl)-4-[(phenylmethyl)amino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-(3-methoxyphenyl)-4-[(phenylmethyl)amino]cyclohexane-1-carboxylate Openeye Name: methyl 4-(benzylamino)-1-(3-methoxyphenyl)cyclohexanecarboxylate CAS Name: 1-(3-methoxyphenyl)-4-[(phenylmethyl)amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-(benzylamino)-1-(3-methoxyphenyl)cyclohexane-1-carboxylate Traditional Name: 4-(benzylamino)-1-(3-methoxyphenyl)cyclohexanecarboxylic acid methyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCC(CC2)NCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCC(CC2)NCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H27NO3/c1-25-20-10-6-9-18(15-20)22(21(24)26-2)13-11-19(12-14-22)23-16-17-7-4-3-5-8-17/h3-10,15,19,23H,11-14,16H2,1-2H3