3-ethoxycarbonyl-2-[(4-methoxyphenyl)methyl]-1-phenylmethoxycarbonyl-piperidine-3-carboxylic acid

Systemtic Name: 3-ethoxycarbonyl-2-[(4-methoxyphenyl)methyl]-1-phenylmethoxycarbonyl-piperidine-3-carboxylic acid Openeye Name: 1-benzyloxycarbonyl-3-ethoxycarbonyl-2-[(4-methoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 3-ethoxycarbonyl-2-[(4-methoxyphenyl)methyl]-1-phenylmethoxycarbonyl-3-piperidinecarboxylic acid IUPAC Name: 3-ethoxycarbonyl-2-[(4-methoxyphenyl)methyl]-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid Traditional Name: 3-carbethoxy-1-carbobenzoxy-2-p-anisyl-nipecotic acid Formula: C25H29NO7 MolecularWeight: 455.50026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1CC2=CC=C(C=C2)OC)C(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCOC(=O)C1(CCCN(C1CC2=CC=C(C=C2)OC)C(=O)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C25H29NO7/c1-3-32-23(29)25(22(27)28)14-7-15-26(24(30)33-17-19-8-5-4-6-9-19)21(25)16-18-10-12-20(31-2)13-11-18/h4-6,8-13,21H,3,7,14-17H2,1-2H3,(H,27,28)