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

Systemtic Name: ethyl 1-[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(4-bromoanilino)-2-oxo-ethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[2-(4-bromoanilino)-2-oxoethyl]-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-bromoanilino)-2-oxoethyl]-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-(4-bromoanilino)-2-keto-ethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H21BrN2O3 MolecularWeight: 441.31774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrN2O3/c1-3-28-22(27)19-13-20(16-7-5-4-6-8-16)25(15(19)2)14-21(26)24-18-11-9-17(23)10-12-18/h4-13H,3,14H2,1-2H3,(H,24,26)