4-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)but-3-en-1-one

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)but-3-en-1-one Openeye Name: 4-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)but-3-en-1-one CAS Name: 4-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)-3-buten-1-one IUPAC Name: 4-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)but-3-en-1-one Traditional Name: 4-(1,3-benzodioxol-5-yl)-1-(4-bromophenyl)but-3-en-1-one Formula: C17H13BrO3 MolecularWeight: 345.18732

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=CCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H13BrO3/c18-14-7-5-13(6-8-14)15(19)3-1-2-12-4-9-16-17(10-12)21-11-20-16/h1-2,4-10H,3,11H2