4-[2-[3-oxidanyl-1-[4-[1-(1-oxidanylpropyl)cyclopropyl]phenyl]pyrrolidin-2-yl]ethyl]benzoic acid

Systemtic Name: 4-[2-[3-oxidanyl-1-[4-[1-(1-oxidanylpropyl)cyclopropyl]phenyl]pyrrolidin-2-yl]ethyl]benzoic acid Openeye Name: 4-[2-[3-hydroxy-1-[4-[1-(1-hydroxypropyl)cyclopropyl]phenyl]pyrrolidin-2-yl]ethyl]benzoic acid CAS Name: 4-[2-[3-hydroxy-1-[4-[1-(1-hydroxypropyl)cyclopropyl]phenyl]-2-pyrrolidinyl]ethyl]benzoic acid IUPAC Name: 4-[2-[3-hydroxy-1-[4-[1-(1-hydroxypropyl)cyclopropyl]phenyl]pyrrolidin-2-yl]ethyl]benzoic acid Traditional Name: 4-[2-[3-hydroxy-1-[4-[1-(1-hydroxypropyl)cyclopropyl]phenyl]pyrrolidin-2-yl]ethyl]benzoic acid Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1(CC1)C2=CC=C(C=C2)N3CCC(C3CCC4=CC=C(C=C4)C(=O)O)O)O

Isomeric SMILES

CCC(C1(CC1)C2=CC=C(C=C2)N3CCC(C3CCC4=CC=C(C=C4)C(=O)O)O)O

InChI

InChI=1S/C25H31NO4/c1-2-23(28)25(14-15-25)19-8-10-20(11-9-19)26-16-13-22(27)21(26)12-5-17-3-6-18(7-4-17)24(29)30/h3-4,6-11,21-23,27-28H,2,5,12-16H2,1H3,(H,29,30)