3-[3-(4-tert-butylphenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4-one

Systemtic Name: 3-[3-(4-tert-butylphenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4-one Openeye Name: 3-[3-(4-tert-butylphenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4-one CAS Name: 3-[3-(4-tert-butylphenoxy)propyl]-2-(4-chlorophenyl)-4-quinazolinone IUPAC Name: 3-[3-(4-tert-butylphenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4-one Traditional Name: 3-[3-(4-tert-butylphenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4-one Formula: C27H27ClN2O2 MolecularWeight: 446.96848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H27ClN2O2/c1-27(2,3)20-11-15-22(16-12-20)32-18-6-17-30-25(19-9-13-21(28)14-10-19)29-24-8-5-4-7-23(24)26(30)31/h4-5,7-16H,6,17-18H2,1-3H3