4-chloranyl-2-nitro-6-[(Z)-(4-oxidanylidenequinazolin-3-yl)iminomethyl]phenolate

Systemtic Name: 4-chloranyl-2-nitro-6-[(Z)-(4-oxidanylidenequinazolin-3-yl)iminomethyl]phenolate Openeye Name: 4-chloro-2-nitro-6-[(Z)-(4-oxoquinazolin-3-yl)iminomethyl]phenolate CAS Name: 4-chloro-2-nitro-6-[(Z)-(4-oxo-3-quinazolinyl)iminomethyl]phenolate IUPAC Name: 4-chloro-2-nitro-6-[(Z)-(4-oxoquinazolin-3-yl)iminomethyl]phenolate Traditional Name: 4-chloro-2-[(Z)-(4-ketoquinazolin-3-yl)iminomethyl]-6-nitro-phenolate Formula: C15H8ClN4O4- MolecularWeight: 343.70142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C15H9ClN4O4/c16-10-5-9(14(21)13(6-10)20(23)24)7-18-19-8-17-12-4-2-1-3-11(12)15(19)22/h1-8,21H/p-1/b18-7-