3-[(5-ethanoyl-2-methoxy-phenyl)methyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-[(5-ethanoyl-2-methoxy-phenyl)methyl]-6-nitro-quinazolin-4-one Openeye Name: 3-[(5-acetyl-2-methoxy-phenyl)methyl]-6-nitro-quinazolin-4-one CAS Name: 3-[(5-acetyl-2-methoxyphenyl)methyl]-6-nitro-4-quinazolinone IUPAC Name: 3-[(5-acetyl-2-methoxyphenyl)methyl]-6-nitroquinazolin-4-one Traditional Name: 3-(5-acetyl-2-methoxy-benzyl)-6-nitro-quinazolin-4-one Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15N3O5/c1-11(22)12-3-6-17(26-2)13(7-12)9-20-10-19-16-5-4-14(21(24)25)8-15(16)18(20)23/h3-8,10H,9H2,1-2H3