2-nitro-4-[(E)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)ethenyl]phenolate

Systemtic Name: 2-nitro-4-[(E)-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)ethenyl]phenolate Openeye Name: 2-nitro-4-[(E)-2-(4-oxo-3-phenyl-quinazolin-2-yl)vinyl]phenolate CAS Name: 2-nitro-4-[(E)-2-(4-oxo-3-phenyl-2-quinazolinyl)ethenyl]phenolate IUPAC Name: 2-nitro-4-[(E)-2-(4-oxo-3-phenylquinazolin-2-yl)ethenyl]phenolate Traditional Name: 4-[(E)-2-(4-keto-3-phenyl-quinazolin-2-yl)vinyl]-2-nitro-phenolate Formula: C22H14N3O4- MolecularWeight: 384.36426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)C=CC4=CC(=C(C=C4)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CC(=C(C=C4)[O-])[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O4/c26-20-12-10-15(14-19(20)25(28)29)11-13-21-23-18-9-5-4-8-17(18)22(27)24(21)16-6-2-1-3-7-16/h1-14,26H/p-1/b13-11+