diethyl (E)-2-(1-ethoxycarbonylindol-3-yl)-3-ethoxycarbonyloxy-but-2-enedioate

Systemtic Name: diethyl (E)-2-(1-ethoxycarbonylindol-3-yl)-3-ethoxycarbonyloxy-but-2-enedioate Openeye Name: diethyl (E)-2-(1-ethoxycarbonylindol-3-yl)-3-ethoxycarbonyloxy-but-2-enedioate CAS Name: (E)-2-(1-ethoxycarbonyl-3-indolyl)-3-ethoxycarbonyloxy-2-butenedioic acid diethyl ester IUPAC Name: diethyl (E)-2-(1-ethoxycarbonylindol-3-yl)-3-ethoxycarbonyloxybut-2-enedioate Traditional Name: (E)-2-(1-carbethoxyindol-3-yl)-3-carbethoxyoxy-but-2-enedioic acid diethyl ester Formula: C22H25NO9 MolecularWeight: 447.4352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C(=O)OCC)OC(=O)OCC)C1=CN(C2=CC=CC=C21)C(=O)OCC

Isomeric SMILES

CCOC(=O)/C(=C(\C(=O)OCC)/OC(=O)OCC)/C1=CN(C2=CC=CC=C21)C(=O)OCC

InChI

InChI=1S/C22H25NO9/c1-5-28-19(24)17(18(20(25)29-6-2)32-22(27)31-8-4)15-13-23(21(26)30-7-3)16-12-10-9-11-14(15)16/h9-13H,5-8H2,1-4H3/b18-17+