(E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)-1-(3,4-dimethylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)-1-(3,4-dimethylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-1-(3,4-dimethylphenyl)prop-2-en-1-one CAS Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-1-(3,4-dimethylphenyl)-2-propen-1-one IUPAC Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-1-(3,4-dimethylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(6-bromo-1,3-benzodioxol-5-yl)-1-(3,4-dimethylphenyl)prop-2-en-1-one Formula: C18H15BrO3 MolecularWeight: 359.2139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C=CC2=CC3=C(C=C2Br)OCO3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)/C=C/C2=CC3=C(C=C2Br)OCO3)C

InChI

InChI=1S/C18H15BrO3/c1-11-3-4-14(7-12(11)2)16(20)6-5-13-8-17-18(9-15(13)19)22-10-21-17/h3-9H,10H2,1-2H3/b6-5+