3-(2-methylpropyl)-6-nitro-quinazolin-4-one

Systemtic Name: 3-(2-methylpropyl)-6-nitro-quinazolin-4-one Openeye Name: 3-isobutyl-6-nitro-quinazolin-4-one CAS Name: 3-(2-methylpropyl)-6-nitro-4-quinazolinone IUPAC Name: 3-(2-methylpropyl)-6-nitroquinazolin-4-one Traditional Name: 3-isobutyl-6-nitro-quinazolin-4-one Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CN1C=NC2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O3/c1-8(2)6-14-7-13-11-4-3-9(15(17)18)5-10(11)12(14)16/h3-5,7-8H,6H2,1-2H3