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

Systemtic Name: dimethyl 5-azanyl-3-[(4-methoxy-2-oxidanyl-phenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(2-hydroxy-4-methoxy-benzoyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(2-hydroxy-4-methoxyphenyl)-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(2-hydroxy-4-methoxybenzoyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(2-hydroxy-4-methoxy-benzoyl)oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H17NO8S MolecularWeight: 395.38378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC)O

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC)O

InChI

InChI=1S/C17H17NO8S/c1-23-8-4-5-9(11(19)6-8)15(20)26-7-10-12(16(21)24-2)14(18)27-13(10)17(22)25-3/h4-6,19H,7,18H2,1-3H3