[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: [2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl] 4-chloranyl-1-methyl-pyrrole-2-carboxylate Openeye Name: [2-(2,5-dimethylphenyl)-2-oxo-ethyl] 4-chloro-1-methyl-pyrrole-2-carboxylate CAS Name: 4-chloro-1-methyl-2-pyrrolecarboxylic acid [2-(2,5-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylphenyl)-2-oxoethyl] 4-chloro-1-methylpyrrole-2-carboxylate Traditional Name: 4-chloro-1-methyl-pyrrole-2-carboxylic acid [2-(2,5-dimethylphenyl)-2-keto-ethyl] ester Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC(=CN2C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC(=CN2C)Cl

InChI

InChI=1S/C16H16ClNO3/c1-10-4-5-11(2)13(6-10)15(19)9-21-16(20)14-7-12(17)8-18(14)3/h4-8H,9H2,1-3H3