[2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(thiophen-2-ylcarbonylamino)ethyl] (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] (E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-propenoic acid [2-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(thiophene-2-carbonylamino)ethyl] (E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)acrylic acid [2-keto-2-(2-thenoylamino)ethyl] ester Formula: C17H12ClNO6S MolecularWeight: 393.79828

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=CC(=O)OCC(=O)NC(=O)C3=CC=CS3)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C/C(=O)OCC(=O)NC(=O)C3=CC=CS3)Cl

InChI

InChI=1S/C17H12ClNO6S/c18-11-6-10(7-12-16(11)25-9-24-12)3-4-15(21)23-8-14(20)19-17(22)13-2-1-5-26-13/h1-7H,8-9H2,(H,19,20,22)/b4-3+