(E)-1-(2,2-diethanoyl-1,3-benzodioxol-5-yl)-3-(3,4-dimethoxy-5-thiophen-2-yl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(2,2-diethanoyl-1,3-benzodioxol-5-yl)-3-(3,4-dimethoxy-5-thiophen-2-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(2,2-diacetyl-1,3-benzodioxol-5-yl)-3-[3,4-dimethoxy-5-(2-thienyl)phenyl]prop-2-en-1-one CAS Name: (E)-1-(2,2-diacetyl-1,3-benzodioxol-5-yl)-3-(3,4-dimethoxy-5-thiophen-2-ylphenyl)-2-propen-1-one IUPAC Name: (E)-1-(2,2-diacetyl-1,3-benzodioxol-5-yl)-3-(3,4-dimethoxy-5-thiophen-2-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(2,2-diacetyl-1,3-benzodioxol-5-yl)-3-[3,4-dimethoxy-5-(2-thienyl)phenyl]prop-2-en-1-one Formula: C26H22O7S MolecularWeight: 478.51368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(OC2=C(O1)C=C(C=C2)C(=O)C=CC3=CC(=C(C(=C3)C4=CC=CS4)OC)OC)C(=O)C

Isomeric SMILES

CC(=O)C1(OC2=C(O1)C=C(C=C2)C(=O)/C=C/C3=CC(=C(C(=C3)C4=CC=CS4)OC)OC)C(=O)C

InChI

InChI=1S/C26H22O7S/c1-15(27)26(16(2)28)32-21-10-8-18(14-22(21)33-26)20(29)9-7-17-12-19(24-6-5-11-34-24)25(31-4)23(13-17)30-3/h5-14H,1-4H3/b9-7+