(phenylmethyl) (2R,3S)-2-(4-methoxyphenyl)-3-phenylmethoxy-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2R,3S)-2-(4-methoxyphenyl)-3-phenylmethoxy-piperidine-1-carboxylate Openeye Name: benzyl (2R,3S)-3-benzyloxy-2-(4-methoxyphenyl)piperidine-1-carboxylate CAS Name: (2R,3S)-2-(4-methoxyphenyl)-3-phenylmethoxy-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,3S)-2-(4-methoxyphenyl)-3-phenylmethoxypiperidine-1-carboxylate Traditional Name: (2R,3S)-3-benzoxy-2-(4-methoxyphenyl)piperidine-1-carboxylic acid benzyl ester Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(CCCN2C(=O)OCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2[C@H](CCCN2C(=O)OCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H29NO4/c1-30-24-16-14-23(15-17-24)26-25(31-19-21-9-4-2-5-10-21)13-8-18-28(26)27(29)32-20-22-11-6-3-7-12-22/h2-7,9-12,14-17,25-26H,8,13,18-20H2,1H3/t25-,26+/m0/s1