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

Systemtic Name: 2-(4-chlorophenyl)-3-[4-(2-methoxy-4-prop-2-enyl-phenoxy)butyl]quinazolin-4-one Openeye Name: 3-[4-(4-allyl-2-methoxy-phenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4-one CAS Name: 2-(4-chlorophenyl)-3-[4-(2-methoxy-4-prop-2-enylphenoxy)butyl]-4-quinazolinone IUPAC Name: 2-(4-chlorophenyl)-3-[4-(2-methoxy-4-prop-2-enylphenoxy)butyl]quinazolin-4-one Traditional Name: 3-[4-(4-allyl-2-methoxy-phenoxy)butyl]-2-(4-chlorophenyl)quinazolin-4-one Formula: C28H27ClN2O3 MolecularWeight: 474.97858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H27ClN2O3/c1-3-8-20-11-16-25(26(19-20)33-2)34-18-7-6-17-31-27(21-12-14-22(29)15-13-21)30-24-10-5-4-9-23(24)28(31)32/h3-5,9-16,19H,1,6-8,17-18H2,2H3