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

Systemtic Name: 1-[(4-dimethylaminophenyl)-(2,4-dimethylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-dimethylaminophenyl)-(2,4-dimethylphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-dimethylaminophenyl)-(2,4-dimethylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-dimethylaminophenyl)-(2,4-dimethylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-dimethylaminophenyl)-(2,4-dimethylphenyl)methyl]pipecolinic acid Formula: C23H30N2O2 MolecularWeight: 366.4965

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C2=CC=C(C=C2)N(C)C)N3CCCCC3C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C2=CC=C(C=C2)N(C)C)N3CCCCC3C(=O)O)C

InChI

InChI=1S/C23H30N2O2/c1-16-8-13-20(17(2)15-16)22(18-9-11-19(12-10-18)24(3)4)25-14-6-5-7-21(25)23(26)27/h8-13,15,21-22H,5-7,14H2,1-4H3,(H,26,27)