3-methoxy-4-[(3-oxidanyl-2-propyl-4-pyrrolidin-1-ylcarbonyl-phenoxy)methyl]benzoic acid

Systemtic Name: 3-methoxy-4-[(3-oxidanyl-2-propyl-4-pyrrolidin-1-ylcarbonyl-phenoxy)methyl]benzoic acid Openeye Name: 4-[[3-hydroxy-2-propyl-4-(pyrrolidine-1-carbonyl)phenoxy]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[3-hydroxy-4-[oxo(1-pyrrolidinyl)methyl]-2-propylphenoxy]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[3-hydroxy-2-propyl-4-(pyrrolidine-1-carbonyl)phenoxy]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[3-hydroxy-2-propyl-4-(pyrrolidine-1-carbonyl)phenoxy]methyl]-3-methoxy-benzoic acid Formula: C23H27NO6 MolecularWeight: 413.46358

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)N2CCCC2)OCC3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)N2CCCC2)OCC3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C23H27NO6/c1-3-6-17-19(10-9-18(21(17)25)22(26)24-11-4-5-12-24)30-14-16-8-7-15(23(27)28)13-20(16)29-2/h7-10,13,25H,3-6,11-12,14H2,1-2H3,(H,27,28)