(Z)-3-(1,3-benzodioxol-5-ylmethylamino)-1-(4-bromophenyl)but-2-en-1-one

Systemtic Name: (Z)-3-(1,3-benzodioxol-5-ylmethylamino)-1-(4-bromophenyl)but-2-en-1-one Openeye Name: (Z)-3-(1,3-benzodioxol-5-ylmethylamino)-1-(4-bromophenyl)but-2-en-1-one CAS Name: (Z)-3-(1,3-benzodioxol-5-ylmethylamino)-1-(4-bromophenyl)-2-buten-1-one IUPAC Name: (Z)-3-(1,3-benzodioxol-5-ylmethylamino)-1-(4-bromophenyl)but-2-en-1-one Traditional Name: (Z)-1-(4-bromophenyl)-3-(piperonylamino)but-2-en-1-one Formula: C18H16BrNO3 MolecularWeight: 374.22854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=CC=C(C=C1)Br)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=C/C(=O)C1=CC=C(C=C1)Br)/NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H16BrNO3/c1-12(8-16(21)14-3-5-15(19)6-4-14)20-10-13-2-7-17-18(9-13)23-11-22-17/h2-9,20H,10-11H2,1H3/b12-8-