ethyl 1-[2-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[2-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(4-bromo-2-chloro-anilino)-2-oxo-ethyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[2-(4-bromo-2-chloroanilino)-2-oxoethyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-bromo-2-chloroanilino)-2-oxoethyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[2-(4-bromo-2-chloro-anilino)-2-keto-ethyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C17H18BrClN2O3 MolecularWeight: 413.69342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)NC2=C(C=C(C=C2)Br)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC(=O)NC2=C(C=C(C=C2)Br)Cl)C

InChI

InChI=1S/C17H18BrClN2O3/c1-4-24-17(23)13-7-10(2)21(11(13)3)9-16(22)20-15-6-5-12(18)8-14(15)19/h5-8H,4,9H2,1-3H3,(H,20,22)