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

Systemtic Name: ethyl 1-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-2,4-dimethyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-2,4-dimethyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-(3-chloro-4-fluoro-anilino)-2-keto-ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H22ClFN2O3 MolecularWeight: 428.883783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C)C2=CC=CC=C2)CC(=O)NC3=CC(=C(C=C3)F)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C)C2=CC=CC=C2)CC(=O)NC3=CC(=C(C=C3)F)Cl)C

InChI

InChI=1S/C23H22ClFN2O3/c1-4-30-23(29)21-14(2)22(16-8-6-5-7-9-16)27(15(21)3)13-20(28)26-17-10-11-19(25)18(24)12-17/h5-12H,4,13H2,1-3H3,(H,26,28)