ethyl 7-[2-oxidanylidene-5-(3-oxidanyl-4-thiophen-2-yl-butyl)pyrrolidin-1-yl]heptanoate

Systemtic Name: ethyl 7-[2-oxidanylidene-5-(3-oxidanyl-4-thiophen-2-yl-butyl)pyrrolidin-1-yl]heptanoate Openeye Name: ethyl 7-[2-[3-hydroxy-4-(2-thienyl)butyl]-5-oxo-pyrrolidin-1-yl]heptanoate CAS Name: 7-[2-(3-hydroxy-4-thiophen-2-ylbutyl)-5-oxo-1-pyrrolidinyl]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2-(3-hydroxy-4-thiophen-2-ylbutyl)-5-oxopyrrolidin-1-yl]heptanoate Traditional Name: 7-[2-[3-hydroxy-4-(2-thienyl)butyl]-5-keto-pyrrolidino]enanthic acid ethyl ester Formula: C21H33NO4S MolecularWeight: 395.55602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCN1C(CCC1=O)CCC(CC2=CC=CS2)O

Isomeric SMILES

CCOC(=O)CCCCCCN1C(CCC1=O)CCC(CC2=CC=CS2)O

InChI

InChI=1S/C21H33NO4S/c1-2-26-21(25)9-5-3-4-6-14-22-17(11-13-20(22)24)10-12-18(23)16-19-8-7-15-27-19/h7-8,15,17-18,23H,2-6,9-14,16H2,1H3