methyl 2-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]-5-ethanoyl-4-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]-5-ethanoyl-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-acetyl-2-[2-(4-bromoanilino)-2-oxo-ethyl]-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-acetyl-2-[2-(4-bromoanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-acetyl-2-[2-(4-bromoanilino)-2-oxoethyl]-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-acetyl-2-[2-(4-bromoanilino)-2-keto-ethyl]-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C17H17BrN2O4 MolecularWeight: 393.23188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)CC(=O)NC2=CC=C(C=C2)Br)C(=O)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)CC(=O)NC2=CC=C(C=C2)Br)C(=O)C

InChI

InChI=1S/C17H17BrN2O4/c1-9-15(17(23)24-3)13(20-16(9)10(2)21)8-14(22)19-12-6-4-11(18)5-7-12/h4-7,20H,8H2,1-3H3,(H,19,22)