1-[(3-methylphenyl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(3-methylphenyl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[m-tolyl-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[(3-methylphenyl)-(3-phenoxyphenyl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(3-methylphenyl)-(3-phenoxyphenyl)methyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[m-tolyl-(3-phenoxyphenyl)methyl]proline Formula: C25H25NO3 MolecularWeight: 387.4709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCC4C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCC4C(=O)O

InChI

InChI=1S/C25H25NO3/c1-18-8-5-9-19(16-18)24(26-15-7-14-23(26)25(27)28)20-10-6-13-22(17-20)29-21-11-3-2-4-12-21/h2-6,8-13,16-17,23-24H,7,14-15H2,1H3,(H,27,28)