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

Systemtic Name: diethyl 5-azanyl-3-[[4-(hydroxymethyl)phenyl]carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 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 diethyl ester IUPAC Name: diethyl 5-amino-3-[[4-(hydroxymethyl)benzoyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(4-methylolbenzoyl)oxymethyl]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H21NO7S MolecularWeight: 407.43754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC=C(C=C2)CO)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC=C(C=C2)CO)C(=O)OCC)N

InChI

InChI=1S/C19H21NO7S/c1-3-25-18(23)14-13(15(28-16(14)20)19(24)26-4-2)10-27-17(22)12-7-5-11(9-21)6-8-12/h5-8,21H,3-4,9-10,20H2,1-2H3