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

Systemtic Name: 2-ethoxycarbonyl-2-[(4-methoxyphenyl)methyl]-1-phenylmethoxycarbonyl-piperidine-3-carboxylic acid Openeye Name: 1-benzyloxycarbonyl-2-ethoxycarbonyl-2-[(4-methoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 2-ethoxycarbonyl-2-[(4-methoxyphenyl)methyl]-1-phenylmethoxycarbonyl-3-piperidinecarboxylic acid IUPAC Name: 2-ethoxycarbonyl-2-[(4-methoxyphenyl)methyl]-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid Traditional Name: 2-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(C(CCCN1C(=O)OCC2=CC=CC=C2)C(=O)O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1(C(CCCN1C(=O)OCC2=CC=CC=C2)C(=O)O)CC3=CC=C(C=C3)OC

InChI

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