ethyl 4-[4-(1-adamantylcarbonyl)piperazin-1-yl]sulfonyl-5-methyl-furan-2-carboxylate

Systemtic Name: ethyl 4-[4-(1-adamantylcarbonyl)piperazin-1-yl]sulfonyl-5-methyl-furan-2-carboxylate Openeye Name: ethyl 4-[4-(adamantane-1-carbonyl)piperazin-1-yl]sulfonyl-5-methyl-furan-2-carboxylate CAS Name: 4-[[4-[1-adamantyl(oxo)methyl]-1-piperazinyl]sulfonyl]-5-methyl-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(adamantane-1-carbonyl)piperazin-1-yl]sulfonyl-5-methylfuran-2-carboxylate Traditional Name: 4-[4-(adamantane-1-carbonyl)piperazino]sulfonyl-5-methyl-furan-2-carboxylic acid ethyl ester Formula: C23H32N2O6S MolecularWeight: 464.57498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(O1)C)S(=O)(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=CC(=C(O1)C)S(=O)(=O)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H32N2O6S/c1-3-30-21(26)19-11-20(15(2)31-19)32(28,29)25-6-4-24(5-7-25)22(27)23-12-16-8-17(13-23)10-18(9-16)14-23/h11,16-18H,3-10,12-14H2,1-2H3