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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1C=CC(=O)CC2=CC=CC=C2)CCCCCCC(=O)O

Isomeric SMILES

C1CC(=O)N(C1/C=C/C(=O)CC2=CC=CC=C2)CCCCCCC(=O)O

InChI

InChI=1S/C21H27NO4/c23-19(16-17-8-4-3-5-9-17)13-11-18-12-14-20(24)22(18)15-7-2-1-6-10-21(25)26/h3-5,8-9,11,13,18H,1-2,6-7,10,12,14-16H2,(H,25,26)/b13-11+