(4-methylphenyl) (3R)-3-(furan-2-ylmethylcarbamoyl)piperidine-1-sulfonate

Systemtic Name: (4-methylphenyl) (3R)-3-(furan-2-ylmethylcarbamoyl)piperidine-1-sulfonate Openeye Name: p-tolyl (3R)-3-(2-furylmethylcarbamoyl)piperidine-1-sulfonate CAS Name: (3R)-3-[(2-furanylmethylamino)-oxomethyl]-1-piperidinesulfonic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) (3R)-3-(furan-2-ylmethylcarbamoyl)piperidine-1-sulfonate Traditional Name: (3R)-3-(2-furfurylcarbamoyl)piperidine-1-sulfonic acid p-tolyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OS(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

CC1=CC=C(C=C1)OS(=O)(=O)N2CCC[C@H](C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C18H22N2O5S/c1-14-6-8-16(9-7-14)25-26(22,23)20-10-2-4-15(13-20)18(21)19-12-17-5-3-11-24-17/h3,5-9,11,15H,2,4,10,12-13H2,1H3,(H,19,21)/t15-/m1/s1