(phenylmethyl) 4-[bis(3,4-dimethoxyphenyl)-oxidanyl-methyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[bis(3,4-dimethoxyphenyl)-oxidanyl-methyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[bis(3,4-dimethoxyphenyl)-hydroxy-methyl]piperidine-1-carboxylate CAS Name: 4-[bis(3,4-dimethoxyphenyl)-hydroxymethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[bis(3,4-dimethoxyphenyl)-hydroxymethyl]piperidine-1-carboxylate Traditional Name: 4-[bis(3,4-dimethoxyphenyl)-hydroxy-methyl]piperidine-1-carboxylic acid benzyl ester Formula: C30H35NO7 MolecularWeight: 521.6014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2CCN(CC2)C(=O)OCC3=CC=CC=C3)(C4=CC(=C(C=C4)OC)OC)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2CCN(CC2)C(=O)OCC3=CC=CC=C3)(C4=CC(=C(C=C4)OC)OC)O)OC

InChI

InChI=1S/C30H35NO7/c1-34-25-12-10-23(18-27(25)36-3)30(33,24-11-13-26(35-2)28(19-24)37-4)22-14-16-31(17-15-22)29(32)38-20-21-8-6-5-7-9-21/h5-13,18-19,22,33H,14-17,20H2,1-4H3