5-(4-chlorophenyl)carbonyl-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

Systemtic Name: 5-(4-chlorophenyl)carbonyl-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 5-(4-chlorobenzoyl)-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 5-[(4-chlorophenyl)-oxomethyl]-6-(methylthio)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 5-(4-chlorobenzoyl)-6-methylsulfanyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 5-(4-chlorobenzoyl)-6-(methylthio)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C16H14ClNO3S MolecularWeight: 335.80526

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=C(N2CCC(C2=C1)C(=O)O)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClNO3S/c1-22-13-8-12-11(16(20)21)6-7-18(12)14(13)15(19)9-2-4-10(17)5-3-9/h2-5,8,11H,6-7H2,1H3,(H,20,21)