ethyl (E)-2-cyano-3-[[2-[(4-fluorophenyl)amino]-5-nitro-phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[[2-[(4-fluorophenyl)amino]-5-nitro-phenyl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[2-(4-fluoroanilino)-5-nitro-anilino]prop-2-enoate CAS Name: (E)-2-cyano-3-[2-(4-fluoroanilino)-5-nitroanilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[2-(4-fluoroanilino)-5-nitroanilino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[2-(4-fluoroanilino)-5-nitro-anilino]acrylic acid ethyl ester Formula: C18H15FN4O4 MolecularWeight: 370.334503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C=CC(=C1)[N+](=O)[O-])NC2=CC=C(C=C2)F)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=C(C=CC(=C1)[N+](=O)[O-])NC2=CC=C(C=C2)F)/C#N

InChI

InChI=1S/C18H15FN4O4/c1-2-27-18(24)12(10-20)11-21-17-9-15(23(25)26)7-8-16(17)22-14-5-3-13(19)4-6-14/h3-9,11,21-22H,2H2,1H3/b12-11+