methyl 3-[2-(2-oxidanylidene-2-piperidin-1-yl-ethanoyl)pyrrol-1-yl]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-(2-oxidanylidene-2-piperidin-1-yl-ethanoyl)pyrrol-1-yl]thiophene-2-carboxylate Openeye Name: methyl 3-[2-[2-oxo-2-(1-piperidyl)acetyl]pyrrol-1-yl]thiophene-2-carboxylate CAS Name: 3-[2-[1,2-dioxo-2-(1-piperidinyl)ethyl]-1-pyrrolyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(2-oxo-2-piperidin-1-ylacetyl)pyrrol-1-yl]thiophene-2-carboxylate Traditional Name: 3-[2-(2-keto-2-piperidino-acetyl)pyrrol-1-yl]thiophene-2-carboxylic acid methyl ester Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)N2C=CC=C2C(=O)C(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=C(C=CS1)N2C=CC=C2C(=O)C(=O)N3CCCCC3

InChI

InChI=1S/C17H18N2O4S/c1-23-17(22)15-13(7-11-24-15)19-10-5-6-12(19)14(20)16(21)18-8-3-2-4-9-18/h5-7,10-11H,2-4,8-9H2,1H3