[4-[(2-methyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]phenyl] 3,5-dinitrobenzoate

Systemtic Name: [4-[(2-methyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [4-[(2-methyl-4-oxo-quinazolin-3-yl)iminomethyl]phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [4-[(2-methyl-4-oxo-3-quinazolinyl)iminomethyl]phenyl] ester IUPAC Name: [4-[(2-methyl-4-oxoquinazolin-3-yl)iminomethyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [4-[(4-keto-2-methyl-quinazolin-3-yl)iminomethyl]phenyl] ester Formula: C23H15N5O7 MolecularWeight: 473.3945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1N=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1N=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H15N5O7/c1-14-25-21-5-3-2-4-20(21)22(29)26(14)24-13-15-6-8-19(9-7-15)35-23(30)16-10-17(27(31)32)12-18(11-16)28(33)34/h2-13H,1H3