ethyl (Z)-3-[(4-bromophenyl)amino]-2-(2-fluoranyl-4-pyridin-4-yl-phenyl)carbonyl-prop-2-enoate

Systemtic Name: ethyl (Z)-3-[(4-bromophenyl)amino]-2-(2-fluoranyl-4-pyridin-4-yl-phenyl)carbonyl-prop-2-enoate Openeye Name: ethyl (Z)-3-(4-bromoanilino)-2-[2-fluoro-4-(4-pyridyl)benzoyl]prop-2-enoate CAS Name: (Z)-3-(4-bromoanilino)-2-[(2-fluoro-4-pyridin-4-ylphenyl)-oxomethyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-(4-bromoanilino)-2-(2-fluoro-4-pyridin-4-ylbenzoyl)prop-2-enoate Traditional Name: (Z)-3-(4-bromoanilino)-2-[2-fluoro-4-(4-pyridyl)benzoyl]acrylic acid ethyl ester Formula: C23H18BrFN2O3 MolecularWeight: 469.303023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=C(C=C1)Br)C(=O)C2=C(C=C(C=C2)C3=CC=NC=C3)F

Isomeric SMILES

CCOC(=O)/C(=C\NC1=CC=C(C=C1)Br)/C(=O)C2=C(C=C(C=C2)C3=CC=NC=C3)F

InChI

InChI=1S/C23H18BrFN2O3/c1-2-30-23(29)20(14-27-18-6-4-17(24)5-7-18)22(28)19-8-3-16(13-21(19)25)15-9-11-26-12-10-15/h3-14,27H,2H2,1H3/b20-14-