(E)-1-(4-bromophenyl)-3-[6-(2-dimethylaminoethyl)-4-methoxy-1,3-benzodioxol-5-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-bromophenyl)-3-[6-(2-dimethylaminoethyl)-4-methoxy-1,3-benzodioxol-5-yl]prop-2-en-1-one Openeye Name: (E)-1-(4-bromophenyl)-3-[6-(2-dimethylaminoethyl)-4-methoxy-1,3-benzodioxol-5-yl]prop-2-en-1-one CAS Name: (E)-1-(4-bromophenyl)-3-[6-(2-dimethylaminoethyl)-4-methoxy-1,3-benzodioxol-5-yl]-2-propen-1-one IUPAC Name: (E)-1-(4-bromophenyl)-3-[6-(2-dimethylaminoethyl)-4-methoxy-1,3-benzodioxol-5-yl]prop-2-en-1-one Traditional Name: (E)-1-(4-bromophenyl)-3-[6-(2-dimethylaminoethyl)-4-methoxy-1,3-benzodioxol-5-yl]prop-2-en-1-one Formula: C21H22BrNO4 MolecularWeight: 432.30768

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CC2=C(C(=C1C=CC(=O)C3=CC=C(C=C3)Br)OC)OCO2

Isomeric SMILES

CN(C)CCC1=CC2=C(C(=C1/C=C/C(=O)C3=CC=C(C=C3)Br)OC)OCO2

InChI

InChI=1S/C21H22BrNO4/c1-23(2)11-10-15-12-19-21(27-13-26-19)20(25-3)17(15)8-9-18(24)14-4-6-16(22)7-5-14/h4-9,12H,10-11,13H2,1-3H3/b9-8+