[4-[(2-ethyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[(2-ethyl-4-oxidanylidene-quinazolin-3-yl)iminomethyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[(2-ethyl-4-oxo-quinazolin-3-yl)iminomethyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(2-ethyl-4-oxo-3-quinazolinyl)iminomethyl]phenyl] ester IUPAC Name: [4-[(2-ethyl-4-oxoquinazolin-3-yl)iminomethyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(2-ethyl-4-keto-quinazolin-3-yl)iminomethyl]phenyl] ester Formula: C24H18N4O5 MolecularWeight: 442.42352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=O)N1N=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=O)N1N=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H18N4O5/c1-2-22-26-21-9-4-3-8-20(21)23(29)27(22)25-15-16-10-12-19(13-11-16)33-24(30)17-6-5-7-18(14-17)28(31)32/h3-15H,2H2,1H3