(4-oxidanylidene-4-thiophen-2-yl-butyl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-propenoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)acrylic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C18H16O5S MolecularWeight: 344.38164

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)OCCCC(=O)C3=CC=CS3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C(=O)OCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C18H16O5S/c19-14(17-4-2-10-24-17)3-1-9-21-18(20)8-6-13-5-7-15-16(11-13)23-12-22-15/h2,4-8,10-11H,1,3,9,12H2/b8-6+