3-[(2,5-dimethylphenyl)methyl]-6-nitro-quinazolin-4-one

Systemtic Name: 3-[(2,5-dimethylphenyl)methyl]-6-nitro-quinazolin-4-one Openeye Name: 3-[(2,5-dimethylphenyl)methyl]-6-nitro-quinazolin-4-one CAS Name: 3-[(2,5-dimethylphenyl)methyl]-6-nitro-4-quinazolinone IUPAC Name: 3-[(2,5-dimethylphenyl)methyl]-6-nitroquinazolin-4-one Traditional Name: 3-(2,5-dimethylbenzyl)-6-nitro-quinazolin-4-one Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O3/c1-11-3-4-12(2)13(7-11)9-19-10-18-16-6-5-14(20(22)23)8-15(16)17(19)21/h3-8,10H,9H2,1-2H3