1-(2-bromanyl-4-methyl-phenyl)pyrrole-2-carboxylate

Systemtic Name: 1-(2-bromanyl-4-methyl-phenyl)pyrrole-2-carboxylate Openeye Name: 1-(2-bromo-4-methyl-phenyl)pyrrole-2-carboxylate CAS Name: 1-(2-bromo-4-methylphenyl)-2-pyrrolecarboxylate IUPAC Name: 1-(2-bromo-4-methylphenyl)pyrrole-2-carboxylate Traditional Name: 1-(2-bromo-4-methyl-phenyl)pyrrole-2-carboxylate Formula: C12H9BrNO2- MolecularWeight: 279.10936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CC=C2C(=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CC=C2C(=O)[O-])Br

InChI

InChI=1S/C12H10BrNO2/c1-8-4-5-10(9(13)7-8)14-6-2-3-11(14)12(15)16/h2-7H,1H3,(H,15,16)/p-1