3-[1-[4-[(4-chlorophenyl)methoxy]phenyl]-5-oxidanylidene-pyrrolidin-3-yl]-2-methoxy-benzoic acid

Systemtic Name: 3-[1-[4-[(4-chlorophenyl)methoxy]phenyl]-5-oxidanylidene-pyrrolidin-3-yl]-2-methoxy-benzoic acid Openeye Name: 3-[1-[4-[(4-chlorophenyl)methoxy]phenyl]-5-oxo-pyrrolidin-3-yl]-2-methoxy-benzoic acid CAS Name: 3-[1-[4-[(4-chlorophenyl)methoxy]phenyl]-5-oxo-3-pyrrolidinyl]-2-methoxybenzoic acid IUPAC Name: 3-[1-[4-[(4-chlorophenyl)methoxy]phenyl]-5-oxopyrrolidin-3-yl]-2-methoxybenzoic acid Traditional Name: 3-[1-[4-(4-chlorobenzyl)oxyphenyl]-5-keto-pyrrolidin-3-yl]-2-methoxy-benzoic acid Formula: C25H22ClNO5 MolecularWeight: 451.89888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1C2CC(=O)N(C2)C3=CC=C(C=C3)OCC4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

COC1=C(C=CC=C1C2CC(=O)N(C2)C3=CC=C(C=C3)OCC4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C25H22ClNO5/c1-31-24-21(3-2-4-22(24)25(29)30)17-13-23(28)27(14-17)19-9-11-20(12-10-19)32-15-16-5-7-18(26)8-6-16/h2-12,17H,13-15H2,1H3,(H,29,30)