methyl 2-methyl-5-[(6-nitro-4-oxidanylidene-quinazolin-3-yl)methyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[(6-nitro-4-oxidanylidene-quinazolin-3-yl)methyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[(6-nitro-4-oxo-quinazolin-3-yl)methyl]furan-3-carboxylate CAS Name: 2-methyl-5-[(6-nitro-4-oxo-3-quinazolinyl)methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(6-nitro-4-oxoquinazolin-3-yl)methyl]furan-3-carboxylate Traditional Name: 5-[(4-keto-6-nitro-quinazolin-3-yl)methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C16H13N3O6 MolecularWeight: 343.29092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C16H13N3O6/c1-9-12(16(21)24-2)6-11(25-9)7-18-8-17-14-4-3-10(19(22)23)5-13(14)15(18)20/h3-6,8H,7H2,1-2H3