5-ethoxycarbonyl-4-(methoxymethyl)-2-(octoxycarbonylamino)thiophene-3-carboxylic acid

Systemtic Name: 5-ethoxycarbonyl-4-(methoxymethyl)-2-(octoxycarbonylamino)thiophene-3-carboxylic acid Openeye Name: 5-ethoxycarbonyl-4-(methoxymethyl)-2-(octoxycarbonylamino)thiophene-3-carboxylic acid CAS Name: 5-ethoxycarbonyl-4-(methoxymethyl)-2-[[octoxy(oxo)methyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 5-ethoxycarbonyl-4-(methoxymethyl)-2-(octoxycarbonylamino)thiophene-3-carboxylic acid Traditional Name: 5-carbethoxy-4-(methoxymethyl)-2-(octoxycarbonylamino)-3-thenoic acid Formula: C19H29NO7S MolecularWeight: 415.50106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)NC1=C(C(=C(S1)C(=O)OCC)COC)C(=O)O

Isomeric SMILES

CCCCCCCCOC(=O)NC1=C(C(=C(S1)C(=O)OCC)COC)C(=O)O

InChI

InChI=1S/C19H29NO7S/c1-4-6-7-8-9-10-11-27-19(24)20-16-14(17(21)22)13(12-25-3)15(28-16)18(23)26-5-2/h4-12H2,1-3H3,(H,20,24)(H,21,22)