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

Systemtic Name: 1-[(2-bromophenyl)-(2,4-dimethylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(2-bromophenyl)-(2,4-dimethylphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(2-bromophenyl)-(2,4-dimethylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(2-bromophenyl)-(2,4-dimethylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(2-bromophenyl)-(2,4-dimethylphenyl)methyl]proline Formula: C20H22BrNO2 MolecularWeight: 388.29818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C2=CC=CC=C2Br)N3CCCC3C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C2=CC=CC=C2Br)N3CCCC3C(=O)O)C

InChI

InChI=1S/C20H22BrNO2/c1-13-9-10-15(14(2)12-13)19(16-6-3-4-7-17(16)21)22-11-5-8-18(22)20(23)24/h3-4,6-7,9-10,12,18-19H,5,8,11H2,1-2H3,(H,23,24)