[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: [2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: [2-(3-methoxyanilino)-2-oxo-ethyl] 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-(3-methoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyanilino)-2-oxoethyl] 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid [2-keto-2-(m-anisidino)ethyl] ester Formula: C14H13BrN2O4 MolecularWeight: 353.16802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)COC(=O)C2=CC(=CN2)Br

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)COC(=O)C2=CC(=CN2)Br

InChI

InChI=1S/C14H13BrN2O4/c1-20-11-4-2-3-10(6-11)17-13(18)8-21-14(19)12-5-9(15)7-16-12/h2-7,16H,8H2,1H3,(H,17,18)