3-[6-(4-chloranyl-3-ethyl-phenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one

Systemtic Name: 3-[6-(4-chloranyl-3-ethyl-phenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one Openeye Name: 3-[6-(4-chloro-3-ethyl-phenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one CAS Name: 3-[6-(4-chloro-3-ethylphenoxy)hexyl]-2-(4-methoxyphenyl)-4-quinazolinone IUPAC Name: 3-[6-(4-chloro-3-ethylphenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 3-[6-(4-chloro-3-ethyl-phenoxy)hexyl]-2-(4-methoxyphenyl)quinazolin-4-one Formula: C29H31ClN2O3 MolecularWeight: 491.02104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)OCCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)OCCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)Cl

InChI

InChI=1S/C29H31ClN2O3/c1-3-21-20-24(16-17-26(21)30)35-19-9-5-4-8-18-32-28(22-12-14-23(34-2)15-13-22)31-27-11-7-6-10-25(27)29(32)33/h6-7,10-17,20H,3-5,8-9,18-19H2,1-2H3