[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: [2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: [2-(5-chloro-2-thienyl)-2-oxo-ethyl] 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-cyclopropyl-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(5-chloro-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-chlorothiophen-2-yl)-2-oxoethyl] 1-cyclopropyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-cyclopropyl-2,5-dimethyl-pyrrole-3-carboxylic acid [2-(5-chloro-2-thienyl)-2-keto-ethyl] ester Formula: C16H16ClNO3S MolecularWeight: 337.82114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)OCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)OCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H16ClNO3S/c1-9-7-12(10(2)18(9)11-3-4-11)16(20)21-8-13(19)14-5-6-15(17)22-14/h5-7,11H,3-4,8H2,1-2H3