3-(4-chlorophenyl)-2-phenyl-4aH-quinazolin-3-ium-4-one

Systemtic Name: 3-(4-chlorophenyl)-2-phenyl-4aH-quinazolin-3-ium-4-one Openeye Name: 3-(4-chlorophenyl)-2-phenyl-4aH-quinazolin-3-ium-4-one CAS Name: 3-(4-chlorophenyl)-2-phenyl-4aH-quinazolin-3-ium-4-one IUPAC Name: 3-(4-chlorophenyl)-2-phenyl-4aH-quinazolin-3-ium-4-one Traditional Name: 3-(4-chlorophenyl)-2-phenyl-4aH-quinazolin-3-ium-4-one Formula: C20H14ClN2O+ MolecularWeight: 333.79096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[N+](C(=O)C3C=CC=CC3=N2)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=[N+](C(=O)C3C=CC=CC3=N2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H14ClN2O/c21-15-10-12-16(13-11-15)23-19(14-6-2-1-3-7-14)22-18-9-5-4-8-17(18)20(23)24/h1-13,17H/q+1