8-methoxy-2-(5-nitro-2-propoxy-phenyl)-1H-quinazolin-4-one

Systemtic Name: 8-methoxy-2-(5-nitro-2-propoxy-phenyl)-1H-quinazolin-4-one Openeye Name: 8-methoxy-2-(5-nitro-2-propoxy-phenyl)-1H-quinazolin-4-one CAS Name: 8-methoxy-2-(5-nitro-2-propoxyphenyl)-1H-quinazolin-4-one IUPAC Name: 8-methoxy-2-(5-nitro-2-propoxyphenyl)-1H-quinazolin-4-one Traditional Name: 8-methoxy-2-(5-nitro-2-propoxy-phenyl)-1H-quinazolin-4-one Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC(=O)C3=C(N2)C(=CC=C3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[N+](=O)[O-])C2=NC(=O)C3=C(N2)C(=CC=C3)OC

InChI

InChI=1S/C18H17N3O5/c1-3-9-26-14-8-7-11(21(23)24)10-13(14)17-19-16-12(18(22)20-17)5-4-6-15(16)25-2/h4-8,10H,3,9H2,1-2H3,(H,19,20,22)