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

Systemtic Name: 2-(4-chlorophenyl)-3-[6-(4-propan-2-ylphenoxy)hexyl]quinazolin-4-one Openeye Name: 2-(4-chlorophenyl)-3-[6-(4-isopropylphenoxy)hexyl]quinazolin-4-one CAS Name: 2-(4-chlorophenyl)-3-[6-(4-propan-2-ylphenoxy)hexyl]-4-quinazolinone IUPAC Name: 2-(4-chlorophenyl)-3-[6-(4-propan-2-ylphenoxy)hexyl]quinazolin-4-one Traditional Name: 2-(4-chlorophenyl)-3-[6-(4-isopropylphenoxy)hexyl]quinazolin-4-one Formula: C29H31ClN2O2 MolecularWeight: 475.02164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H31ClN2O2/c1-21(2)22-13-17-25(18-14-22)34-20-8-4-3-7-19-32-28(23-11-15-24(30)16-12-23)31-27-10-6-5-9-26(27)29(32)33/h5-6,9-18,21H,3-4,7-8,19-20H2,1-2H3