ethyl 1-[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylate CAS Name: 1-[2-(2-bromo-4-methylanilino)-2-oxoethyl]-2-methyl-5-(4-methylphenyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2-bromo-4-methylanilino)-2-oxoethyl]-2-methyl-5-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 1-[2-(2-bromo-4-methyl-anilino)-2-keto-ethyl]-2-methyl-5-(p-tolyl)pyrrole-3-carboxylic acid ethyl ester Formula: C24H25BrN2O3 MolecularWeight: 469.3709

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CC(=O)NC3=C(C=C(C=C3)C)Br)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)C)CC(=O)NC3=C(C=C(C=C3)C)Br)C

InChI

InChI=1S/C24H25BrN2O3/c1-5-30-24(29)19-13-22(18-9-6-15(2)7-10-18)27(17(19)4)14-23(28)26-21-11-8-16(3)12-20(21)25/h6-13H,5,14H2,1-4H3,(H,26,28)