ethyl 5-[4-(phenylcarbonyl)piperazin-1-yl]sulfonylfuran-2-carboxylate

Systemtic Name: ethyl 5-[4-(phenylcarbonyl)piperazin-1-yl]sulfonylfuran-2-carboxylate Openeye Name: ethyl 5-(4-benzoylpiperazin-1-yl)sulfonylfuran-2-carboxylate CAS Name: 5-[(4-benzoyl-1-piperazinyl)sulfonyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-benzoylpiperazin-1-yl)sulfonylfuran-2-carboxylate Traditional Name: 5-(4-benzoylpiperazino)sulfonylfuran-2-carboxylic acid ethyl ester Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O6S/c1-2-25-18(22)15-8-9-16(26-15)27(23,24)20-12-10-19(11-13-20)17(21)14-6-4-3-5-7-14/h3-9H,2,10-13H2,1H3