3-[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-6-nitro-quinazolin-4-one Openeye Name: 3-[2-(2,4-dimethoxyphenyl)-2-oxo-ethyl]-6-nitro-quinazolin-4-one CAS Name: 3-[2-(2,4-dimethoxyphenyl)-2-oxoethyl]-6-nitro-4-quinazolinone IUPAC Name: 3-[2-(2,4-dimethoxyphenyl)-2-oxoethyl]-6-nitroquinazolin-4-one Traditional Name: 3-[2-(2,4-dimethoxyphenyl)-2-keto-ethyl]-6-nitro-quinazolin-4-one Formula: C18H15N3O6 MolecularWeight: 369.3282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H15N3O6/c1-26-12-4-5-13(17(8-12)27-2)16(22)9-20-10-19-15-6-3-11(21(24)25)7-14(15)18(20)23/h3-8,10H,9H2,1-2H3