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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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