7-[(5S)-2-oxidanylidene-5-(4-oxidanyl-4-phenyl-butyl)pyrrolidin-1-yl]heptanoic acid

Systemtic Name: 7-[(5S)-2-oxidanylidene-5-(4-oxidanyl-4-phenyl-butyl)pyrrolidin-1-yl]heptanoic acid Openeye Name: 7-[(2S)-2-(4-hydroxy-4-phenyl-butyl)-5-oxo-pyrrolidin-1-yl]heptanoic acid CAS Name: 7-[(2S)-2-(4-hydroxy-4-phenylbutyl)-5-oxo-1-pyrrolidinyl]heptanoic acid IUPAC Name: 7-[(2S)-2-(4-hydroxy-4-phenylbutyl)-5-oxopyrrolidin-1-yl]heptanoic acid Traditional Name: 7-[(2S)-2-(4-hydroxy-4-phenyl-butyl)-5-keto-pyrrolidino]enanthic acid Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1CCCC(C2=CC=CC=C2)O)CCCCCCC(=O)O

Isomeric SMILES

C1CC(=O)N([C@H]1CCCC(C2=CC=CC=C2)O)CCCCCCC(=O)O

InChI

InChI=1S/C21H31NO4/c23-19(17-9-4-3-5-10-17)12-8-11-18-14-15-20(24)22(18)16-7-2-1-6-13-21(25)26/h3-5,9-10,18-19,23H,1-2,6-8,11-16H2,(H,25,26)/t18-,19?/m0/s1