2-[(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)amino]-4-methyl-5-phenyl-thiophene-3-carboxylic acid

Systemtic Name: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxidanylidene-prop-1-enyl)amino]-4-methyl-5-phenyl-thiophene-3-carboxylic acid Openeye Name: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxo-prop-1-enyl)amino]-4-methyl-5-phenyl-thiophene-3-carboxylic acid CAS Name: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]-4-methyl-5-phenyl-3-thiophenecarboxylic acid IUPAC Name: 2-[(3-ethoxy-2-ethoxycarbonyl-3-oxoprop-1-enyl)amino]-4-methyl-5-phenylthiophene-3-carboxylic acid Traditional Name: 2-[(2-carbethoxy-3-ethoxy-3-keto-prop-1-enyl)amino]-4-methyl-5-phenyl-3-thenoic acid Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=C(C(=C(S1)C2=CC=CC=C2)C)C(=O)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=C(C(=C(S1)C2=CC=CC=C2)C)C(=O)O)C(=O)OCC

InChI

InChI=1S/C20H21NO6S/c1-4-26-19(24)14(20(25)27-5-2)11-21-17-15(18(22)23)12(3)16(28-17)13-9-7-6-8-10-13/h6-11,21H,4-5H2,1-3H3,(H,22,23)