(4-methylsulfanylphenyl)methyl 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 3-(2-oxo-1-pyrrolidinyl)benzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 3-(2-ketopyrrolidino)benzoic acid [4-(methylthio)benzyl] ester Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)N3CCCC3=O

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)N3CCCC3=O

InChI

InChI=1S/C19H19NO3S/c1-24-17-9-7-14(8-10-17)13-23-19(22)15-4-2-5-16(12-15)20-11-3-6-18(20)21/h2,4-5,7-10,12H,3,6,11,13H2,1H3