1-[(5-chloranyl-2-methoxy-phenyl)-(2,4-dimethylphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(2,4-dimethylphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(2,4-dimethylphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(2,4-dimethylphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(2,4-dimethylphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(2,4-dimethylphenyl)methyl]proline Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClNO3/c1-13-6-8-16(14(2)11-13)20(23-10-4-5-18(23)21(24)25)17-12-15(22)7-9-19(17)26-3/h6-9,11-12,18,20H,4-5,10H2,1-3H3,(H,24,25)