3-(methoxymethyl)-5-(octoxycarbonylamino)thiophene-2,4-dicarboxylic acid

Systemtic Name: 3-(methoxymethyl)-5-(octoxycarbonylamino)thiophene-2,4-dicarboxylic acid Openeye Name: 3-(methoxymethyl)-5-(octoxycarbonylamino)thiophene-2,4-dicarboxylic acid CAS Name: 3-(methoxymethyl)-5-[[octoxy(oxo)methyl]amino]thiophene-2,4-dicarboxylic acid IUPAC Name: 3-(methoxymethyl)-5-(octoxycarbonylamino)thiophene-2,4-dicarboxylic acid Traditional Name: 3-(methoxymethyl)-5-(octoxycarbonylamino)thiophene-2,4-dicarboxylic acid Formula: C17H25NO7S MolecularWeight: 387.4479

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO7S/c1-3-4-5-6-7-8-9-25-17(23)18-14-12(15(19)20)11(10-24-2)13(26-14)16(21)22/h3-10H2,1-2H3,(H,18,23)(H,19,20)(H,21,22)