(4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C19H18N4O6/c1-28-9-8-20-15-7-6-12(23(26)27)10-14(15)19(25)29-11-17-21-16-5-3-2-4-13(16)18(24)22-17/h2-7,10,20H,8-9,11H2,1H3,(H,21,22,24)