(4-methylphenyl)methyl 4-chloranyl-1H-pyrrole-2-carboxylate

Systemtic Name: (4-methylphenyl)methyl 4-chloranyl-1H-pyrrole-2-carboxylate Openeye Name: p-tolylmethyl 4-chloro-1H-pyrrole-2-carboxylate CAS Name: 4-chloro-1H-pyrrole-2-carboxylic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 4-chloro-1H-pyrrole-2-carboxylate Traditional Name: 4-chloro-1H-pyrrole-2-carboxylic acid (4-methylbenzyl) ester Formula: C13H12ClNO2 MolecularWeight: 249.69288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)C2=CC(=CN2)Cl

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)C2=CC(=CN2)Cl

InChI

InChI=1S/C13H12ClNO2/c1-9-2-4-10(5-3-9)8-17-13(16)12-6-11(14)7-15-12/h2-7,15H,8H2,1H3