dimethyl 5-azanyl-3-[[4-(hydroxymethyl)phenyl]carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[4-(hydroxymethyl)phenyl]carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[4-(hydroxymethyl)benzoyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[4-(hydroxymethyl)phenyl]-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[4-(hydroxymethyl)benzoyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(4-methylolbenzoyl)oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H17NO7S MolecularWeight: 379.38438

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)C2=CC=C(C=C2)CO)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)C2=CC=C(C=C2)CO)C(=O)OC)N

InChI

InChI=1S/C17H17NO7S/c1-23-16(21)12-11(13(17(22)24-2)26-14(12)18)8-25-15(20)10-5-3-9(7-19)4-6-10/h3-6,19H,7-8,18H2,1-2H3