3-(4-oxidanylidenequinazolin-3-yl)propyl 5-nitrofuran-2-carboxylate

Systemtic Name: 3-(4-oxidanylidenequinazolin-3-yl)propyl 5-nitrofuran-2-carboxylate Openeye Name: 3-(4-oxoquinazolin-3-yl)propyl 5-nitrofuran-2-carboxylate CAS Name: 5-nitro-2-furancarboxylic acid 3-(4-oxo-3-quinazolinyl)propyl ester IUPAC Name: 3-(4-oxoquinazolin-3-yl)propyl 5-nitrofuran-2-carboxylate Traditional Name: 5-nitrofuran-2-carboxylic acid 3-(4-ketoquinazolin-3-yl)propyl ester Formula: C16H13N3O6 MolecularWeight: 343.29092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCOC(=O)C3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CCCOC(=O)C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O6/c20-15-11-4-1-2-5-12(11)17-10-18(15)8-3-9-24-16(21)13-6-7-14(25-13)19(22)23/h1-2,4-7,10H,3,8-9H2