3-(1,3-benzodioxol-5-ylmethyl)-2-(3-bromanyl-4-oxidanyl-phenyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3-bromanyl-4-oxidanyl-phenyl)-1,2-dihydroquinazolin-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3-bromo-4-hydroxy-phenyl)-1,2-dihydroquinazolin-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3-bromo-4-hydroxyphenyl)-1,2-dihydroquinazolin-4-one IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-2-(3-bromo-4-hydroxyphenyl)-1,2-dihydroquinazolin-4-one Traditional Name: 2-(3-bromo-4-hydroxy-phenyl)-3-piperonyl-1,2-dihydroquinazolin-4-one Formula: C22H17BrN2O4 MolecularWeight: 453.28538

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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)O)Br

Isomeric SMILES

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

InChI

InChI=1S/C22H17BrN2O4/c23-16-10-14(6-7-18(16)26)21-24-17-4-2-1-3-15(17)22(27)25(21)11-13-5-8-19-20(9-13)29-12-28-19/h1-10,21,24,26H,11-12H2