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

Systemtic Name: dimethyl 5-azanyl-3-[(2-ethylsulfonylphenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(2-ethylsulfonylbenzoyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(2-ethylsulfonylphenyl)-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(2-ethylsulfonylbenzoyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(2-esylbenzoyl)oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C18H19NO8S2 MolecularWeight: 441.47536

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C18H19NO8S2/c1-4-29(23,24)12-8-6-5-7-10(12)16(20)27-9-11-13(17(21)25-2)15(19)28-14(11)18(22)26-3/h5-8H,4,9,19H2,1-3H3