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

Systemtic Name: 3-[(2,5-dimethylphenyl)methyl]-6-nitro-2-propyl-quinazolin-4-one Openeye Name: 3-[(2,5-dimethylphenyl)methyl]-6-nitro-2-propyl-quinazolin-4-one CAS Name: 3-[(2,5-dimethylphenyl)methyl]-6-nitro-2-propyl-4-quinazolinone IUPAC Name: 3-[(2,5-dimethylphenyl)methyl]-6-nitro-2-propylquinazolin-4-one Traditional Name: 3-(2,5-dimethylbenzyl)-6-nitro-2-propyl-quinazolin-4-one Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1CC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1CC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C20H21N3O3/c1-4-5-19-21-18-9-8-16(23(25)26)11-17(18)20(24)22(19)12-15-10-13(2)6-7-14(15)3/h6-11H,4-5,12H2,1-3H3