2-(4-chlorophenyl)-3-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]quinazolin-4-one

Systemtic Name: 2-(4-chlorophenyl)-3-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]quinazolin-4-one Openeye Name: 3-[3-(4-allyl-2-methoxy-phenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4-one CAS Name: 2-(4-chlorophenyl)-3-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-4-quinazolinone IUPAC Name: 2-(4-chlorophenyl)-3-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]quinazolin-4-one Traditional Name: 3-[3-(4-allyl-2-methoxy-phenoxy)propyl]-2-(4-chlorophenyl)quinazolin-4-one Formula: C27H25ClN2O3 MolecularWeight: 460.952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H25ClN2O3/c1-3-7-19-10-15-24(25(18-19)32-2)33-17-6-16-30-26(20-11-13-21(28)14-12-20)29-23-9-5-4-8-22(23)27(30)31/h3-5,8-15,18H,1,6-7,16-17H2,2H3