(4E)-2-nitro-6-oxidanyl-4-(1H-quinazolin-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-2-nitro-6-oxidanyl-4-(1H-quinazolin-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-hydroxy-6-nitro-4-(1H-quinazolin-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-hydroxy-6-nitro-4-(1H-quinazolin-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-hydroxy-6-nitro-4-(1H-quinazolin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-hydroxy-6-nitro-4-(1H-quinazolin-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C14H9N3O4 MolecularWeight: 283.23896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NC(=C3C=C(C(=O)C(=C3)O)[N+](=O)[O-])N2

Isomeric SMILES

C1=CC=C2C(=C1)C=N/C(=C/3\C=C(C(=O)C(=C3)O)[N+](=O)[O-])/N2

InChI

InChI=1S/C14H9N3O4/c18-12-6-9(5-11(13(12)19)17(20)21)14-15-7-8-3-1-2-4-10(8)16-14/h1-7,16,18H/b14-9-