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

Systemtic Name: dimethyl 5-azanyl-3-[(3,4,5-triethoxyphenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(3,4,5-triethoxybenzoyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[oxo-(3,4,5-triethoxyphenyl)methoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(3,4,5-triethoxybenzoyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(3,4,5-triethoxybenzoyl)oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C22H27NO9S MolecularWeight: 481.51608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C22H27NO9S/c1-6-29-14-9-12(10-15(30-7-2)17(14)31-8-3)20(24)32-11-13-16(21(25)27-4)19(23)33-18(13)22(26)28-5/h9-10H,6-8,11,23H2,1-5H3