1-[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxidanylidene-furan-3-yl]piperidin-2-one

Systemtic Name: 1-[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxidanylidene-furan-3-yl]piperidin-2-one Openeye Name: 1-[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxo-3-furyl]piperidin-2-one CAS Name: 1-[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxo-3-furanyl]-2-piperidinone IUPAC Name: 1-[5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-oxofuran-3-yl]piperidin-2-one Traditional Name: 1-[2-keto-4-(4-mesylphenyl)-5,5-dimethyl-3-furyl]-2-piperidone Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)O1)N2CCCCC2=O)C3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1(C(=C(C(=O)O1)N2CCCCC2=O)C3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C18H21NO5S/c1-18(2)15(12-7-9-13(10-8-12)25(3,22)23)16(17(21)24-18)19-11-5-4-6-14(19)20/h7-10H,4-6,11H2,1-3H3