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

Systemtic Name: diethyl 5-azanyl-3-[(3-methoxy-2-oxidanyl-phenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-amino-3-[(2-hydroxy-3-methoxy-benzoyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(2-hydroxy-3-methoxyphenyl)-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-3-[(2-hydroxy-3-methoxybenzoyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(2-hydroxy-3-methoxy-benzoyl)oxymethyl]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H21NO8S MolecularWeight: 423.43694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO8S/c1-4-26-18(23)13-11(15(29-16(13)20)19(24)27-5-2)9-28-17(22)10-7-6-8-12(25-3)14(10)21/h6-8,21H,4-5,9,20H2,1-3H3