quinolin-8-ylmethyl 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: quinolin-8-ylmethyl 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 8-quinolylmethyl 1-(p-tolylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-4-piperidinecarboxylic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 1-(4-methylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-tosylisonipecotic acid 8-quinolylmethyl ester Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C23H24N2O4S/c1-17-7-9-21(10-8-17)30(27,28)25-14-11-19(12-15-25)23(26)29-16-20-5-2-4-18-6-3-13-24-22(18)20/h2-10,13,19H,11-12,14-16H2,1H3