3-[6-(3,5-dimethylphenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one

Systemtic Name: 3-[6-(3,5-dimethylphenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one Openeye Name: 3-[6-(3,5-dimethylphenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one CAS Name: 3-[6-(3,5-dimethylphenoxy)hexyl]-2-(4-methoxyphenyl)-4-quinazolinone IUPAC Name: 3-[6-(3,5-dimethylphenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 3-[6-(3,5-dimethylphenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one Formula: C29H32N2O3 MolecularWeight: 456.57598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C29H32N2O3/c1-21-18-22(2)20-25(19-21)34-17-9-5-4-8-16-31-28(23-12-14-24(33-3)15-13-23)30-27-11-7-6-10-26(27)29(31)32/h6-7,10-15,18-20H,4-5,8-9,16-17H2,1-3H3