2-[(3,4-dichlorophenyl)amino]-8-[(E)-2-imidazol-1-ylethenyl]-6-nitro-1H-quinazolin-4-one

Systemtic Name: 2-[(3,4-dichlorophenyl)amino]-8-[(E)-2-imidazol-1-ylethenyl]-6-nitro-1H-quinazolin-4-one Openeye Name: 2-(3,4-dichloroanilino)-8-[(E)-2-imidazol-1-ylvinyl]-6-nitro-1H-quinazolin-4-one CAS Name: 2-(3,4-dichloroanilino)-8-[(E)-2-(1-imidazolyl)ethenyl]-6-nitro-1H-quinazolin-4-one IUPAC Name: 2-(3,4-dichloroanilino)-8-[(E)-2-imidazol-1-ylethenyl]-6-nitro-1H-quinazolin-4-one Traditional Name: 2-(3,4-dichloroanilino)-8-[(E)-2-imidazol-1-ylvinyl]-6-nitro-1H-quinazolin-4-one Formula: C19H12Cl2N6O3 MolecularWeight: 443.24298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC(=O)C3=CC(=CC(=C3N2)C=CN4C=CN=C4)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC(=O)C3=CC(=CC(=C3N2)/C=C/N4C=CN=C4)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C19H12Cl2N6O3/c20-15-2-1-12(8-16(15)21)23-19-24-17-11(3-5-26-6-4-22-10-26)7-13(27(29)30)9-14(17)18(28)25-19/h1-10H,(H2,23,24,25,28)/b5-3+