3-[(4-methylphenyl)methyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-[(4-methylphenyl)methyl]-6-nitro-quinazolin-4-one Openeye Name: 6-nitro-3-(p-tolylmethyl)quinazolin-4-one CAS Name: 3-[(4-methylphenyl)methyl]-6-nitro-4-quinazolinone IUPAC Name: 3-[(4-methylphenyl)methyl]-6-nitroquinazolin-4-one Traditional Name: 3-(4-methylbenzyl)-6-nitro-quinazolin-4-one Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3/c1-11-2-4-12(5-3-11)9-18-10-17-15-7-6-13(19(21)22)8-14(15)16(18)20/h2-8,10H,9H2,1H3