3-[(4-chlorophenyl)methyl]-2-(4-nitrophenyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: 3-[(4-chlorophenyl)methyl]-2-(4-nitrophenyl)-1,2-dihydroquinazolin-4-one Openeye Name: 3-[(4-chlorophenyl)methyl]-2-(4-nitrophenyl)-1,2-dihydroquinazolin-4-one CAS Name: 3-[(4-chlorophenyl)methyl]-2-(4-nitrophenyl)-1,2-dihydroquinazolin-4-one IUPAC Name: 3-[(4-chlorophenyl)methyl]-2-(4-nitrophenyl)-1,2-dihydroquinazolin-4-one Traditional Name: 3-(4-chlorobenzyl)-2-(4-nitrophenyl)-1,2-dihydroquinazolin-4-one Formula: C21H16ClN3O3 MolecularWeight: 393.82304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(N2)C3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(N2)C3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H16ClN3O3/c22-16-9-5-14(6-10-16)13-24-20(15-7-11-17(12-8-15)25(27)28)23-19-4-2-1-3-18(19)21(24)26/h1-12,20,23H,13H2