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

Systemtic Name: 2-(4-chlorophenyl)-3-[6-(3,5-dimethylphenoxy)hexyl]quinazolin-4-one Openeye Name: 2-(4-chlorophenyl)-3-[6-(3,5-dimethylphenoxy)hexyl]quinazolin-4-one CAS Name: 2-(4-chlorophenyl)-3-[6-(3,5-dimethylphenoxy)hexyl]-4-quinazolinone IUPAC Name: 2-(4-chlorophenyl)-3-[6-(3,5-dimethylphenoxy)hexyl]quinazolin-4-one Traditional Name: 2-(4-chlorophenyl)-3-[6-(3,5-dimethylphenoxy)hexyl]quinazolin-4-one Formula: C28H29ClN2O2 MolecularWeight: 460.99506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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