methyl 5-(4-ethoxyphenyl)carbonyl-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: methyl 5-(4-ethoxyphenyl)carbonyl-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: methyl 5-(4-ethoxybenzoyl)-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-[(4-ethoxyphenyl)-oxomethyl]-6-(methylthio)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-ethoxybenzoyl)-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-(4-ethoxybenzoyl)-6-(methylthio)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C(=O)OC)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)C2=C(C=C3N2CCC3C(=O)OC)SC

InChI

InChI=1S/C19H21NO4S/c1-4-24-13-7-5-12(6-8-13)18(21)17-16(25-3)11-15-14(19(22)23-2)9-10-20(15)17/h5-8,11,14H,4,9-10H2,1-3H3