diethyl 5-azanyl-3-[(4-ethanoyl-1H-pyrrol-2-yl)carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-azanyl-3-[(4-ethanoyl-1H-pyrrol-2-yl)carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-[(4-acetyl-1H-pyrrole-2-carbonyl)oxymethyl]-5-amino-thiophene-2,4-dicarboxylate CAS Name: 3-[[(4-acetyl-1H-pyrrol-2-yl)-oxomethoxy]methyl]-5-aminothiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-[(4-acetyl-1H-pyrrole-2-carbonyl)oxymethyl]-5-aminothiophene-2,4-dicarboxylate Traditional Name: 3-[(4-acetyl-1H-pyrrole-2-carbonyl)oxymethyl]-5-amino-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H20N2O7S MolecularWeight: 408.4256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC(=CN2)C(=O)C)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1COC(=O)C2=CC(=CN2)C(=O)C)C(=O)OCC)N

InChI

InChI=1S/C18H20N2O7S/c1-4-25-17(23)13-11(14(28-15(13)19)18(24)26-5-2)8-27-16(22)12-6-10(7-20-12)9(3)21/h6-7,20H,4-5,8,19H2,1-3H3