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

Systemtic Name: 4-[[1-[2-(cyclohexylmethoxy)phenyl]-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-[2-(cyclohexylmethoxy)phenyl]-5-oxo-pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[1-[2-(cyclohexylmethoxy)phenyl]-5-oxo-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[1-[2-(cyclohexylmethoxy)phenyl]-5-oxopyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[1-[2-(cyclohexylmethoxy)phenyl]-5-keto-pyrrolidin-3-yl]methoxy]benzoic acid Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC2=CC=CC=C2N3CC(CC3=O)COC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CCC(CC1)COC2=CC=CC=C2N3CC(CC3=O)COC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H29NO5/c27-24-14-19(17-30-21-12-10-20(11-13-21)25(28)29)15-26(24)22-8-4-5-9-23(22)31-16-18-6-2-1-3-7-18/h4-5,8-13,18-19H,1-3,6-7,14-17H2,(H,28,29)