1-[(2,5-dimethylphenyl)-(3-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(2,5-dimethylphenyl)-(3-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2,5-dimethylphenyl)-(3-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2,5-dimethylphenyl)-(3-methoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2,5-dimethylphenyl)-(3-methoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2,5-dimethylphenyl)-(3-methoxyphenyl)methyl]proline Formula: C21H25NO3 MolecularWeight: 339.4281

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO3/c1-14-9-10-15(2)18(12-14)20(16-6-4-7-17(13-16)25-3)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)