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

Systemtic Name: 1-[(2,3-dimethoxyphenyl)-(3,4-dimethoxyphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,3-dimethoxyphenyl)-(3,4-dimethoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,3-dimethoxyphenyl)-(3,4-dimethoxyphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,3-dimethoxyphenyl)-(3,4-dimethoxyphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,3-dimethoxyphenyl)-(3,4-dimethoxyphenyl)methyl]nipecotic acid Formula: C23H29NO6 MolecularWeight: 415.47946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=C(C(=CC=C2)OC)OC)N3CCCC(C3)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=C(C(=CC=C2)OC)OC)N3CCCC(C3)C(=O)O)OC

InChI

InChI=1S/C23H29NO6/c1-27-18-11-10-15(13-20(18)29-3)21(24-12-6-7-16(14-24)23(25)26)17-8-5-9-19(28-2)22(17)30-4/h5,8-11,13,16,21H,6-7,12,14H2,1-4H3,(H,25,26)