methyl 4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 4-[(3-bromophenyl)methyl]-2-methyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(3-bromobenzyl)-2-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C14H14BrNO2 MolecularWeight: 308.17046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN1)CC2=CC(=CC=C2)Br)C(=O)OC

Isomeric SMILES

CC1=C(C(=CN1)CC2=CC(=CC=C2)Br)C(=O)OC

InChI

InChI=1S/C14H14BrNO2/c1-9-13(14(17)18-2)11(8-16-9)6-10-4-3-5-12(15)7-10/h3-5,7-8,16H,6H2,1-2H3