methyl 1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxylate Openeye Name: methyl 1-(m-tolylmethylsulfonyl)piperidine-4-carboxylate CAS Name: 1-[(3-methylphenyl)methylsulfonyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(3-methylphenyl)methylsulfonyl]piperidine-4-carboxylate Traditional Name: 1-(3-methylbenzyl)sulfonylisonipecotic acid methyl ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)CS(=O)(=O)N2CCC(CC2)C(=O)OC

InChI

InChI=1S/C15H21NO4S/c1-12-4-3-5-13(10-12)11-21(18,19)16-8-6-14(7-9-16)15(17)20-2/h3-5,10,14H,6-9,11H2,1-2H3