triethyl (E)-4-cyano-3-thiophen-2-yl-but-1-ene-1,2,4-tricarboxylate

Systemtic Name: triethyl (E)-4-cyano-3-thiophen-2-yl-but-1-ene-1,2,4-tricarboxylate Openeye Name: triethyl (E)-4-cyano-3-(2-thienyl)but-1-ene-1,2,4-tricarboxylate CAS Name: (E)-4-cyano-3-thiophen-2-yl-1-butene-1,2,4-tricarboxylic acid triethyl ester IUPAC Name: triethyl (E)-4-cyano-3-thiophen-2-ylbut-1-ene-1,2,4-tricarboxylate Traditional Name: (E)-4-cyano-3-(2-thienyl)but-1-ene-1,2,4-tricarboxylic acid triethyl ester Formula: C18H21NO6S MolecularWeight: 379.42744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C(C1=CC=CS1)C(C#N)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)/C=C(\C(C1=CC=CS1)C(C#N)C(=O)OCC)/C(=O)OCC

InChI

InChI=1S/C18H21NO6S/c1-4-23-15(20)10-12(17(21)24-5-2)16(14-8-7-9-26-14)13(11-19)18(22)25-6-3/h7-10,13,16H,4-6H2,1-3H3/b12-10+