(2-methoxy-5-nitro-phenyl)methyl 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate

Systemtic Name: (2-methoxy-5-nitro-phenyl)methyl 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate Openeye Name: (2-methoxy-5-nitro-phenyl)methyl 3-(4-oxo-1H-quinazolin-2-yl)propanoate CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid (2-methoxy-5-nitrophenyl)methyl ester IUPAC Name: (2-methoxy-5-nitrophenyl)methyl 3-(4-oxo-1H-quinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)propionic acid (2-methoxy-5-nitro-benzyl) ester Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])COC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C19H17N3O6/c1-27-16-7-6-13(22(25)26)10-12(16)11-28-18(23)9-8-17-20-15-5-3-2-4-14(15)19(24)21-17/h2-7,10H,8-9,11H2,1H3,(H,20,21,24)