ethyl 5-(4-methylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: ethyl 5-(4-methylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: ethyl 5-(4-methylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-[[4-(methylthio)phenyl]-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-methylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-[4-(methylthio)benzoyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid ethyl ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN2C1=CC=C2C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCOC(=O)C1CCN2C1=CC=C2C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C18H19NO3S/c1-3-22-18(21)14-10-11-19-15(14)8-9-16(19)17(20)12-4-6-13(23-2)7-5-12/h4-9,14H,3,10-11H2,1-2H3