1-[(2,4-dimethylphenyl)-(3-methylphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,4-dimethylphenyl)-(3-methylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,4-dimethylphenyl)-(m-tolyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,4-dimethylphenyl)-(3-methylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,4-dimethylphenyl)-(3-methylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,4-dimethylphenyl)-(m-tolyl)methyl]proline Formula: C21H25NO2 MolecularWeight: 323.4287

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=C(C=C(C=C2)C)C)N3CCCC3C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=C(C=C(C=C2)C)C)N3CCCC3C(=O)O

InChI

InChI=1S/C21H25NO2/c1-14-6-4-7-17(13-14)20(18-10-9-15(2)12-16(18)3)22-11-5-8-19(22)21(23)24/h4,6-7,9-10,12-13,19-20H,5,8,11H2,1-3H3,(H,23,24)