2-(4-chlorophenyl)-3-[6-(2-propan-2-yloxyphenoxy)hexyl]quinazolin-4-one

Systemtic Name: 2-(4-chlorophenyl)-3-[6-(2-propan-2-yloxyphenoxy)hexyl]quinazolin-4-one Openeye Name: 2-(4-chlorophenyl)-3-[6-(2-isopropoxyphenoxy)hexyl]quinazolin-4-one CAS Name: 2-(4-chlorophenyl)-3-[6-(2-propan-2-yloxyphenoxy)hexyl]-4-quinazolinone IUPAC Name: 2-(4-chlorophenyl)-3-[6-(2-propan-2-yloxyphenoxy)hexyl]quinazolin-4-one Traditional Name: 2-(4-chlorophenyl)-3-[6-(2-isopropoxyphenoxy)hexyl]quinazolin-4-one Formula: C29H31ClN2O3 MolecularWeight: 491.02104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1OCCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C)OC1=CC=CC=C1OCCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H31ClN2O3/c1-21(2)35-27-14-8-7-13-26(27)34-20-10-4-3-9-19-32-28(22-15-17-23(30)18-16-22)31-25-12-6-5-11-24(25)29(32)33/h5-8,11-18,21H,3-4,9-10,19-20H2,1-2H3