4-[2-[2-[(Z)-4-cyclopropyl-3-oxidanyl-but-1-enyl]-5-oxidanylidene-pyrrolidin-1-yl]ethyl]benzoic acid

Systemtic Name: 4-[2-[2-[(Z)-4-cyclopropyl-3-oxidanyl-but-1-enyl]-5-oxidanylidene-pyrrolidin-1-yl]ethyl]benzoic acid Openeye Name: 4-[2-[2-[(Z)-4-cyclopropyl-3-hydroxy-but-1-enyl]-5-oxo-pyrrolidin-1-yl]ethyl]benzoic acid CAS Name: 4-[2-[2-[(Z)-4-cyclopropyl-3-hydroxybut-1-enyl]-5-oxo-1-pyrrolidinyl]ethyl]benzoic acid IUPAC Name: 4-[2-[2-[(Z)-4-cyclopropyl-3-hydroxybut-1-enyl]-5-oxopyrrolidin-1-yl]ethyl]benzoic acid Traditional Name: 4-[2-[2-[(Z)-4-cyclopropyl-3-hydroxy-but-1-enyl]-5-keto-pyrrolidino]ethyl]benzoic acid Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CC(C=CC2CCC(=O)N2CCC3=CC=C(C=C3)C(=O)O)O

Isomeric SMILES

C1CC1CC(/C=C\C2CCC(=O)N2CCC3=CC=C(C=C3)C(=O)O)O

InChI

InChI=1S/C20H25NO4/c22-18(13-15-1-2-15)9-7-17-8-10-19(23)21(17)12-11-14-3-5-16(6-4-14)20(24)25/h3-7,9,15,17-18,22H,1-2,8,10-13H2,(H,24,25)/b9-7-