[1-(phenylmethyl)piperidin-4-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [1-(phenylmethyl)piperidin-4-yl] 3,4,5-trimethoxybenzoate Openeye Name: (1-benzyl-4-piperidyl) 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [1-(phenylmethyl)-4-piperidinyl] ester IUPAC Name: (1-benzylpiperidin-4-yl) 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid (1-benzyl-4-piperidyl) ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H27NO5/c1-25-19-13-17(14-20(26-2)21(19)27-3)22(24)28-18-9-11-23(12-10-18)15-16-7-5-4-6-8-16/h4-8,13-14,18H,9-12,15H2,1-3H3