1-[(2,3-dimethoxyphenyl)-(4-ethoxy-3-methoxy-phenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(2,3-dimethoxyphenyl)-(4-ethoxy-3-methoxy-phenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2,3-dimethoxyphenyl)-(4-ethoxy-3-methoxy-phenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2,3-dimethoxyphenyl)-(4-ethoxy-3-methoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2,3-dimethoxyphenyl)-(4-ethoxy-3-methoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2,3-dimethoxyphenyl)-(4-ethoxy-3-methoxy-phenyl)methyl]pipecolinic acid Formula: C24H31NO6 MolecularWeight: 429.50604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=C(C(=CC=C2)OC)OC)N3CCCCC3C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=C(C(=CC=C2)OC)OC)N3CCCCC3C(=O)O)OC

InChI

InChI=1S/C24H31NO6/c1-5-31-19-13-12-16(15-21(19)29-3)22(25-14-7-6-10-18(25)24(26)27)17-9-8-11-20(28-2)23(17)30-4/h8-9,11-13,15,18,22H,5-7,10,14H2,1-4H3,(H,26,27)