[5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl 1-benzofuran-2-carboxylate

Systemtic Name: [5-azanyl-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl 1-benzofuran-2-carboxylate Openeye Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thienyl]methyl benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)-3-thiophenyl]methyl ester IUPAC Name: [5-amino-4-ethoxycarbonyl-2-(methylcarbamoyl)thiophen-3-yl]methyl 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid [5-amino-4-carbethoxy-2-(methylcarbamoyl)-3-thienyl]methyl ester Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC3=CC=CC=C3O2)C(=O)NC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC3=CC=CC=C3O2)C(=O)NC)N

InChI

InChI=1S/C19H18N2O6S/c1-3-25-19(24)14-11(15(17(22)21-2)28-16(14)20)9-26-18(23)13-8-10-6-4-5-7-12(10)27-13/h4-8H,3,9,20H2,1-2H3,(H,21,22)