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

Systemtic Name: 1-[(3,4-diethoxyphenyl)-(4-dimethylaminophenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,4-diethoxyphenyl)-(4-dimethylaminophenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,4-diethoxyphenyl)-(4-dimethylaminophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,4-diethoxyphenyl)-(4-dimethylaminophenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3,4-diethoxyphenyl)-(4-dimethylaminophenyl)methyl]pipecolinic acid Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC=C(C=C2)N(C)C)N3CCCCC3C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC=C(C=C2)N(C)C)N3CCCCC3C(=O)O)OCC

InChI

InChI=1S/C25H34N2O4/c1-5-30-22-15-12-19(17-23(22)31-6-2)24(18-10-13-20(14-11-18)26(3)4)27-16-8-7-9-21(27)25(28)29/h10-15,17,21,24H,5-9,16H2,1-4H3,(H,28,29)