4-chloranyl-2-nitro-6-[(Z)-(4-oxidanylidene-2-propyl-quinazolin-3-yl)iminomethyl]phenolate

Systemtic Name: 4-chloranyl-2-nitro-6-[(Z)-(4-oxidanylidene-2-propyl-quinazolin-3-yl)iminomethyl]phenolate Openeye Name: 4-chloro-2-nitro-6-[(Z)-(4-oxo-2-propyl-quinazolin-3-yl)iminomethyl]phenolate CAS Name: 4-chloro-2-nitro-6-[(Z)-(4-oxo-2-propyl-3-quinazolinyl)iminomethyl]phenolate IUPAC Name: 4-chloro-2-nitro-6-[(Z)-(4-oxo-2-propylquinazolin-3-yl)iminomethyl]phenolate Traditional Name: 4-chloro-2-[(Z)-(4-keto-2-propyl-quinazolin-3-yl)iminomethyl]-6-nitro-phenolate Formula: C18H14ClN4O4- MolecularWeight: 385.78116

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=O)N1N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=O)N1/N=C\C3=CC(=CC(=C3[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C18H15ClN4O4/c1-2-5-16-21-14-7-4-3-6-13(14)18(25)22(16)20-10-11-8-12(19)9-15(17(11)24)23(26)27/h3-4,6-10,24H,2,5H2,1H3/p-1/b20-10-