3-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)-1,2-dihydroquinazolin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)-1,2-dihydroquinazolin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)-1,2-dihydroquinazolin-4-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(4-bromophenyl)-1,2-dihydroquinazolin-4-one Traditional Name: 2-(4-bromophenyl)-3-piperonyl-1,2-dihydroquinazolin-4-one Formula: C22H17BrN2O3 MolecularWeight: 437.28598

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(NC4=CC=CC=C4C3=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(NC4=CC=CC=C4C3=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C22H17BrN2O3/c23-16-8-6-15(7-9-16)21-24-18-4-2-1-3-17(18)22(26)25(21)12-14-5-10-19-20(11-14)28-13-27-19/h1-11,21,24H,12-13H2