[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 3-(5-iodanylfuran-2-yl)prop-2-enoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] 3-(5-iodanylfuran-2-yl)prop-2-enoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl] 3-(5-iodo-2-furyl)prop-2-enoate CAS Name: 3-(5-iodo-2-furanyl)-2-propenoic acid [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] 3-(5-iodofuran-2-yl)prop-2-enoate Traditional Name: 3-(5-iodo-2-furyl)acrylic acid [2-keto-2-(piperonylamino)ethyl] ester Formula: C17H14INO6 MolecularWeight: 455.20063

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C=CC3=CC=C(O3)I

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)COC(=O)C=CC3=CC=C(O3)I

InChI

InChI=1S/C17H14INO6/c18-15-5-2-12(25-15)3-6-17(21)22-9-16(20)19-8-11-1-4-13-14(7-11)24-10-23-13/h1-7H,8-10H2,(H,19,20)