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

Systemtic Name: 3-[1-[2-(cyclohexylmethoxy)phenyl]-5-oxidanylidene-pyrrolidin-3-yl]-2-methoxy-benzoic acid Openeye Name: 3-[1-[2-(cyclohexylmethoxy)phenyl]-5-oxo-pyrrolidin-3-yl]-2-methoxy-benzoic acid CAS Name: 3-[1-[2-(cyclohexylmethoxy)phenyl]-5-oxo-3-pyrrolidinyl]-2-methoxybenzoic acid IUPAC Name: 3-[1-[2-(cyclohexylmethoxy)phenyl]-5-oxopyrrolidin-3-yl]-2-methoxybenzoic acid Traditional Name: 3-[1-[2-(cyclohexylmethoxy)phenyl]-5-keto-pyrrolidin-3-yl]-2-methoxy-benzoic acid Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=C1C2CC(=O)N(C2)C3=CC=CC=C3OCC4CCCCC4)C(=O)O

Isomeric SMILES

COC1=C(C=CC=C1C2CC(=O)N(C2)C3=CC=CC=C3OCC4CCCCC4)C(=O)O

InChI

InChI=1S/C25H29NO5/c1-30-24-19(10-7-11-20(24)25(28)29)18-14-23(27)26(15-18)21-12-5-6-13-22(21)31-16-17-8-3-2-4-9-17/h5-7,10-13,17-18H,2-4,8-9,14-16H2,1H3,(H,28,29)