3-[3-(4-chloranyl-3,5-dimethyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one

Systemtic Name: 3-[3-(4-chloranyl-3,5-dimethyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one Openeye Name: 3-[3-(4-chloro-3,5-dimethyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one CAS Name: 3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)-4-quinazolinone IUPAC Name: 3-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 3-[3-(4-chloro-3,5-dimethyl-phenoxy)propyl]-2-(4-methoxyphenyl)quinazolin-4-one Formula: C26H25ClN2O3 MolecularWeight: 448.9413

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H25ClN2O3/c1-17-15-21(16-18(2)24(17)27)32-14-6-13-29-25(19-9-11-20(31-3)12-10-19)28-23-8-5-4-7-22(23)26(29)30/h4-5,7-12,15-16H,6,13-14H2,1-3H3