ethyl 3-(2-methyl-6-nitro-4-oxidanylidene-quinazolin-3-yl)propanoate

Systemtic Name: ethyl 3-(2-methyl-6-nitro-4-oxidanylidene-quinazolin-3-yl)propanoate Openeye Name: ethyl 3-(2-methyl-6-nitro-4-oxo-quinazolin-3-yl)propanoate CAS Name: 3-(2-methyl-6-nitro-4-oxo-3-quinazolinyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(2-methyl-6-nitro-4-oxoquinazolin-3-yl)propanoate Traditional Name: 3-(4-keto-2-methyl-6-nitro-quinazolin-3-yl)propionic acid ethyl ester Formula: C14H15N3O5 MolecularWeight: 305.286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C(=NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CCN1C(=NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H15N3O5/c1-3-22-13(18)6-7-16-9(2)15-12-5-4-10(17(20)21)8-11(12)14(16)19/h4-5,8H,3,6-7H2,1-2H3