2-[(E)-1-cyano-2-[5-(4-methyl-2-nitro-phenyl)furan-2-yl]ethenyl]quinazolin-4-olate

Systemtic Name: 2-[(E)-1-cyano-2-[5-(4-methyl-2-nitro-phenyl)furan-2-yl]ethenyl]quinazolin-4-olate Openeye Name: 2-[(E)-1-cyano-2-[5-(4-methyl-2-nitro-phenyl)-2-furyl]vinyl]quinazolin-4-olate CAS Name: 2-[(E)-1-cyano-2-[5-(4-methyl-2-nitrophenyl)-2-furanyl]ethenyl]-4-quinazolinolate IUPAC Name: 2-[(E)-1-cyano-2-[5-(4-methyl-2-nitrophenyl)furan-2-yl]ethenyl]quinazolin-4-olate Traditional Name: 2-[(E)-1-cyano-2-[5-(4-methyl-2-nitro-phenyl)-2-furyl]vinyl]quinazolin-4-olate Formula: C22H13N4O4- MolecularWeight: 397.36302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(O2)C=C(C#N)C3=NC4=CC=CC=C4C(=N3)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C3=NC4=CC=CC=C4C(=N3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H14N4O4/c1-13-6-8-17(19(10-13)26(28)29)20-9-7-15(30-20)11-14(12-23)21-24-18-5-3-2-4-16(18)22(27)25-21/h2-11H,1H3,(H,24,25,27)/p-1/b14-11+