6-ethoxy-5-ethyl-4-nitro-6-quinazolin-2-yl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-ethoxy-5-ethyl-4-nitro-6-quinazolin-2-yl-cyclohexa-2,4-dien-1-one Openeye Name: 6-ethoxy-5-ethyl-4-nitro-6-quinazolin-2-yl-cyclohexa-2,4-dien-1-one CAS Name: 6-ethoxy-5-ethyl-4-nitro-6-(2-quinazolinyl)-1-cyclohexa-2,4-dienone IUPAC Name: 6-ethoxy-5-ethyl-4-nitro-6-quinazolin-2-ylcyclohexa-2,4-dien-1-one Traditional Name: 6-ethoxy-5-ethyl-4-nitro-6-quinazolin-2-yl-cyclohexa-2,4-dien-1-one Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=O)C1(C2=NC3=CC=CC=C3C=N2)OCC)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=CC(=O)C1(C2=NC3=CC=CC=C3C=N2)OCC)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4/c1-3-13-15(21(23)24)9-10-16(22)18(13,25-4-2)17-19-11-12-7-5-6-8-14(12)20-17/h5-11H,3-4H2,1-2H3