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

Systemtic Name: 2-(4-chlorophenyl)-3-[6-(2,6-dimethylphenoxy)hexyl]quinazolin-4-one Openeye Name: 2-(4-chlorophenyl)-3-[6-(2,6-dimethylphenoxy)hexyl]quinazolin-4-one CAS Name: 2-(4-chlorophenyl)-3-[6-(2,6-dimethylphenoxy)hexyl]-4-quinazolinone IUPAC Name: 2-(4-chlorophenyl)-3-[6-(2,6-dimethylphenoxy)hexyl]quinazolin-4-one Traditional Name: 2-(4-chlorophenyl)-3-[6-(2,6-dimethylphenoxy)hexyl]quinazolin-4-one Formula: C28H29ClN2O2 MolecularWeight: 460.99506

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C28H29ClN2O2/c1-20-10-9-11-21(2)26(20)33-19-8-4-3-7-18-31-27(22-14-16-23(29)17-15-22)30-25-13-6-5-12-24(25)28(31)32/h5-6,9-17H,3-4,7-8,18-19H2,1-2H3