1-[(2,5-dimethoxyphenyl)-(2,4,5-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(2,5-dimethoxyphenyl)-(2,4,5-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,5-dimethoxyphenyl)-(2,4,5-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,5-dimethoxyphenyl)-(2,4,5-trimethoxyphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,5-dimethoxyphenyl)-(2,4,5-trimethoxyphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[asaryl-(2,5-dimethoxyphenyl)methyl]nipecotic acid Formula: C24H31NO7 MolecularWeight: 445.50544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(C2=CC(=C(C=C2OC)OC)OC)N3CCCC(C3)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(C2=CC(=C(C=C2OC)OC)OC)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C24H31NO7/c1-28-16-8-9-19(29-2)17(11-16)23(25-10-6-7-15(14-25)24(26)27)18-12-21(31-4)22(32-5)13-20(18)30-3/h8-9,11-13,15,23H,6-7,10,14H2,1-5H3,(H,26,27)