diethyl 5-azanyl-3-[(3-morpholin-4-ylsulfonylphenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-azanyl-3-[(3-morpholin-4-ylsulfonylphenyl)carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-amino-3-[(3-morpholinosulfonylbenzoyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-3-[(3-morpholin-4-ylsulfonylbenzoyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(3-morpholinosulfonylbenzoyl)oxymethyl]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C22H26N2O9S2 MolecularWeight: 526.57984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3)C(=O)OCC)N

InChI

InChI=1S/C22H26N2O9S2/c1-3-31-21(26)17-16(18(34-19(17)23)22(27)32-4-2)13-33-20(25)14-6-5-7-15(12-14)35(28,29)24-8-10-30-11-9-24/h5-7,12H,3-4,8-11,13,23H2,1-2H3