1-[(2,6-dimethoxyphenyl)-(2,3,4-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-(2,3,4-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,6-dimethoxyphenyl)-(2,3,4-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,6-dimethoxyphenyl)-(2,3,4-trimethoxyphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,6-dimethoxyphenyl)-(2,3,4-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,6-dimethoxyphenyl)-(2,3,4-trimethoxyphenyl)methyl]nipecotic acid Formula: C24H31NO7 MolecularWeight: 445.50544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31NO7/c1-28-17-9-6-10-18(29-2)20(17)21(25-13-7-8-15(14-25)24(26)27)16-11-12-19(30-3)23(32-5)22(16)31-4/h6,9-12,15,21H,7-8,13-14H2,1-5H3,(H,26,27)