(4-methylphenyl) 4-[(3R)-3-methylpiperidin-1-yl]carbonylpiperidine-1-sulfonate

Systemtic Name: (4-methylphenyl) 4-[(3R)-3-methylpiperidin-1-yl]carbonylpiperidine-1-sulfonate Openeye Name: p-tolyl 4-[(3R)-3-methylpiperidine-1-carbonyl]piperidine-1-sulfonate CAS Name: 4-[[(3R)-3-methyl-1-piperidinyl]-oxomethyl]-1-piperidinesulfonic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 4-[(3R)-3-methylpiperidine-1-carbonyl]piperidine-1-sulfonate Traditional Name: 4-[(3R)-3-methylpiperidine-1-carbonyl]piperidine-1-sulfonic acid p-tolyl ester Formula: C19H28N2O4S MolecularWeight: 380.50162

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2CCN(CC2)S(=O)(=O)OC3=CC=C(C=C3)C

Isomeric SMILES

C[C@@H]1CCCN(C1)C(=O)C2CCN(CC2)S(=O)(=O)OC3=CC=C(C=C3)C

InChI

InChI=1S/C19H28N2O4S/c1-15-5-7-18(8-6-15)25-26(23,24)21-12-9-17(10-13-21)19(22)20-11-3-4-16(2)14-20/h5-8,16-17H,3-4,9-14H2,1-2H3/t16-/m1/s1