(5-methyl-2-oxidanylidene-oxolan-3-yl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate

Systemtic Name: (5-methyl-2-oxidanylidene-oxolan-3-yl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Openeye Name: (5-methyl-2-oxo-tetrahydrofuran-3-yl) 3-[4-(1-piperidylsulfonyl)phenyl]propanoate CAS Name: 3-[4-(1-piperidinylsulfonyl)phenyl]propanoic acid (5-methyl-2-oxo-3-oxolanyl) ester IUPAC Name: (5-methyl-2-oxooxolan-3-yl) 3-(4-piperidin-1-ylsulfonylphenyl)propanoate Traditional Name: 3-(4-piperidinosulfonylphenyl)propionic acid (2-keto-5-methyl-tetrahydrofuran-3-yl) ester Formula: C19H25NO6S MolecularWeight: 395.4699

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1CC(C(=O)O1)OC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H25NO6S/c1-14-13-17(19(22)25-14)26-18(21)10-7-15-5-8-16(9-6-15)27(23,24)20-11-3-2-4-12-20/h5-6,8-9,14,17H,2-4,7,10-13H2,1H3