(E)-7-[2-oxidanylidene-3-[(E)-1-oxidanyl-4-phenyl-but-1-enyl]pyrrolidin-1-yl]hept-5-enoic acid

Systemtic Name: (E)-7-[2-oxidanylidene-3-[(E)-1-oxidanyl-4-phenyl-but-1-enyl]pyrrolidin-1-yl]hept-5-enoic acid Openeye Name: (E)-7-[3-[(E)-1-hydroxy-4-phenyl-but-1-enyl]-2-oxo-pyrrolidin-1-yl]hept-5-enoic acid CAS Name: (E)-7-[3-[(E)-1-hydroxy-4-phenylbut-1-enyl]-2-oxo-1-pyrrolidinyl]-5-heptenoic acid IUPAC Name: (E)-7-[3-[(E)-1-hydroxy-4-phenylbut-1-enyl]-2-oxopyrrolidin-1-yl]hept-5-enoic acid Traditional Name: (E)-7-[3-[(E)-1-hydroxy-4-phenyl-but-1-enyl]-2-keto-pyrrolidino]hept-5-enoic acid Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1C(=CCCC2=CC=CC=C2)O)CC=CCCCC(=O)O

Isomeric SMILES

C1CN(C(=O)C1/C(=C\CCC2=CC=CC=C2)/O)C/C=C/CCCC(=O)O

InChI

InChI=1S/C21H27NO4/c23-19(12-8-11-17-9-4-3-5-10-17)18-14-16-22(21(18)26)15-7-2-1-6-13-20(24)25/h2-5,7,9-10,12,18,23H,1,6,8,11,13-16H2,(H,24,25)/b7-2+,19-12+