[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrrole-2-carboxylate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 4-chloro-1-methyl-pyrrole-2-carboxylate CAS Name: 4-chloro-1-methyl-2-pyrrolecarboxylic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 4-chloro-1-methylpyrrole-2-carboxylate Traditional Name: 4-chloro-1-methyl-pyrrole-2-carboxylic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C15H14ClNO3S MolecularWeight: 323.79456

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OCC(=O)C2=CC=C(C=C2)SC)Cl

Isomeric SMILES

CN1C=C(C=C1C(=O)OCC(=O)C2=CC=C(C=C2)SC)Cl

InChI

InChI=1S/C15H14ClNO3S/c1-17-8-11(16)7-13(17)15(19)20-9-14(18)10-3-5-12(21-2)6-4-10/h3-8H,9H2,1-2H3