methyl 2-methyl-5-methylsulfonyl-4-piperidin-1-yl-benzoate

Systemtic Name: methyl 2-methyl-5-methylsulfonyl-4-piperidin-1-yl-benzoate Openeye Name: methyl 2-methyl-5-methylsulfonyl-4-(1-piperidyl)benzoate CAS Name: 2-methyl-5-methylsulfonyl-4-(1-piperidinyl)benzoic acid methyl ester IUPAC Name: methyl 2-methyl-5-methylsulfonyl-4-piperidin-1-ylbenzoate Traditional Name: 5-mesyl-2-methyl-4-piperidino-benzoic acid methyl ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)N2CCCCC2

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)N2CCCCC2

InChI

InChI=1S/C15H21NO4S/c1-11-9-13(16-7-5-4-6-8-16)14(21(3,18)19)10-12(11)15(17)20-2/h9-10H,4-8H2,1-3H3