(4-aminocarbonyl-2-nitro-phenyl)methyl 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 3-(3-methyl-4-oxo-quinazolin-2-yl)propanoate CAS Name: 3-(3-methyl-4-oxo-2-quinazolinyl)propanoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 3-(3-methyl-4-oxoquinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-3-methyl-quinazolin-2-yl)propionic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C20H18N4O6 MolecularWeight: 410.38012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)OCC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O6/c1-23-17(22-15-5-3-2-4-14(15)20(23)27)8-9-18(25)30-11-13-7-6-12(19(21)26)10-16(13)24(28)29/h2-7,10H,8-9,11H2,1H3,(H2,21,26)