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

Systemtic Name: 2-[(E)-2-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]-1-cyano-ethenyl]quinazolin-4-olate Openeye Name: 2-[(E)-2-[5-(2-chloro-4-nitro-phenyl)-2-furyl]-1-cyano-vinyl]quinazolin-4-olate CAS Name: 2-[(E)-2-[5-(2-chloro-4-nitrophenyl)-2-furanyl]-1-cyanoethenyl]-4-quinazolinolate IUPAC Name: 2-[(E)-2-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-1-cyanoethenyl]quinazolin-4-olate Traditional Name: 2-[(E)-2-[5-(2-chloro-4-nitro-phenyl)-2-furyl]-1-cyano-vinyl]quinazolin-4-olate Formula: C21H10ClN4O4- MolecularWeight: 417.7815

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C(=CC3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)C#N)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)/C(=C/C3=CC=C(O3)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)/C#N)[O-]

InChI

InChI=1S/C21H11ClN4O4/c22-17-10-13(26(28)29)5-7-15(17)19-8-6-14(30-19)9-12(11-23)20-24-18-4-2-1-3-16(18)21(27)25-20/h1-10H,(H,24,25,27)/p-1/b12-9+