ethyl 7-[(5S)-2-oxidanylidene-5-[(E)-4-oxidanyl-4-phenyl-but-1-enyl]pyrrolidin-1-yl]heptanoate

Systemtic Name: ethyl 7-[(5S)-2-oxidanylidene-5-[(E)-4-oxidanyl-4-phenyl-but-1-enyl]pyrrolidin-1-yl]heptanoate Openeye Name: ethyl 7-[(2S)-2-[(E)-4-hydroxy-4-phenyl-but-1-enyl]-5-oxo-pyrrolidin-1-yl]heptanoate CAS Name: 7-[(2S)-2-[(E)-4-hydroxy-4-phenylbut-1-enyl]-5-oxo-1-pyrrolidinyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[(2S)-2-[(E)-4-hydroxy-4-phenylbut-1-enyl]-5-oxopyrrolidin-1-yl]heptanoate Traditional Name: 7-[(2S)-2-[(E)-4-hydroxy-4-phenyl-but-1-enyl]-5-keto-pyrrolidino]enanthic acid ethyl ester Formula: C23H33NO4 MolecularWeight: 387.51242

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCN1C(CCC1=O)C=CCC(C2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)CCCCCCN1[C@@H](CCC1=O)/C=C/CC(C2=CC=CC=C2)O

InChI

InChI=1S/C23H33NO4/c1-2-28-23(27)15-8-3-4-9-18-24-20(16-17-22(24)26)13-10-14-21(25)19-11-6-5-7-12-19/h5-7,10-13,20-21,25H,2-4,8-9,14-18H2,1H3/b13-10+/t20-,21?/m1/s1