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

Systemtic Name: 1-[(2,4-dimethoxyphenyl)-(2,4-dimethylphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,4-dimethoxyphenyl)-(2,4-dimethylphenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,4-dimethoxyphenyl)-(2,4-dimethylphenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-dimethoxyphenyl)-(2,4-dimethylphenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,4-dimethoxyphenyl)-(2,4-dimethylphenyl)methyl]nipecotic acid Formula: C23H29NO4 MolecularWeight: 383.48066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C2=C(C=C(C=C2)OC)OC)N3CCCC(C3)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C2=C(C=C(C=C2)OC)OC)N3CCCC(C3)C(=O)O)C

InChI

InChI=1S/C23H29NO4/c1-15-7-9-19(16(2)12-15)22(24-11-5-6-17(14-24)23(25)26)20-10-8-18(27-3)13-21(20)28-4/h7-10,12-13,17,22H,5-6,11,14H2,1-4H3,(H,25,26)