diethyl 5-azanyl-3-[2-(4-methylphenyl)ethanoyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-azanyl-3-[2-(4-methylphenyl)ethanoyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-amino-3-[[2-(p-tolyl)acetyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[2-(4-methylphenyl)-1-oxoethoxy]methyl]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-amino-3-[[2-(4-methylphenyl)acetyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-(p-tolyl)acetyl]oxymethyl]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)CC2=CC=C(C=C2)C)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)CC2=CC=C(C=C2)C)C(=O)OCC)N

InChI

InChI=1S/C20H23NO6S/c1-4-25-19(23)16-14(17(28-18(16)21)20(24)26-5-2)11-27-15(22)10-13-8-6-12(3)7-9-13/h6-9H,4-5,10-11,21H2,1-3H3