methyl 1-cyano-4-fluoranyl-3-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-1-phenyl-indene-2-carboxylate

Systemtic Name: methyl 1-cyano-4-fluoranyl-3-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-1-phenyl-indene-2-carboxylate Openeye Name: methyl 1-cyano-4-fluoro-3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-1-phenyl-indene-2-carboxylate CAS Name: 1-cyano-4-fluoro-3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-1-phenyl-2-indenecarboxylic acid methyl ester IUPAC Name: methyl 1-cyano-4-fluoro-3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-1-phenylindene-2-carboxylate Traditional Name: 1-cyano-4-fluoro-3-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-1-phenyl-indene-2-carboxylic acid methyl ester Formula: C26H19FN4O4 MolecularWeight: 470.451863

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C1(C#N)C3=CC=CC=C3)C=CC=C2F)NC(=C(C4=CC=CC=C4)NO)N=O

Isomeric SMILES

COC(=O)C1=C(C2=C(C1(C#N)C3=CC=CC=C3)C=CC=C2F)N/C(=C(/C4=CC=CC=C4)\NO)/N=O

InChI

InChI=1S/C26H19FN4O4/c1-35-25(32)21-23(29-24(31-34)22(30-33)16-9-4-2-5-10-16)20-18(13-8-14-19(20)27)26(21,15-28)17-11-6-3-7-12-17/h2-14,29-30,33H,1H3/b24-22+