4-ethoxycarbonyl-5-(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)-3-methyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-ethoxycarbonyl-5-(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)-3-methyl-1H-pyrrole-2-carboxylic acid Openeye Name: 4-ethoxycarbonyl-5-(3-ethoxy-2-ethoxycarbonyl-3-oxo-prop-1-enyl)-3-methyl-1H-pyrrole-2-carboxylic acid CAS Name: 4-ethoxycarbonyl-5-(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)-3-methyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-ethoxycarbonyl-5-(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)-3-methyl-1H-pyrrole-2-carboxylic acid Traditional Name: 4-carbethoxy-5-(2-carbethoxy-3-ethoxy-3-keto-prop-1-enyl)-3-methyl-1H-pyrrole-2-carboxylic acid Formula: C17H21NO8 MolecularWeight: 367.35054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)O)C=C(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)O)C=C(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C17H21NO8/c1-5-24-15(21)10(16(22)25-6-2)8-11-12(17(23)26-7-3)9(4)13(18-11)14(19)20/h8,18H,5-7H2,1-4H3,(H,19,20)