methyl 4-[(3-methylpiperidin-1-yl)sulfonylmethyl]benzoate

Systemtic Name: methyl 4-[(3-methylpiperidin-1-yl)sulfonylmethyl]benzoate Openeye Name: methyl 4-[(3-methyl-1-piperidyl)sulfonylmethyl]benzoate CAS Name: 4-[(3-methyl-1-piperidinyl)sulfonylmethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-methylpiperidin-1-yl)sulfonylmethyl]benzoate Traditional Name: 4-[(3-methylpiperidino)sulfonylmethyl]benzoic acid methyl ester Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H21NO4S/c1-12-4-3-9-16(10-12)21(18,19)11-13-5-7-14(8-6-13)15(17)20-2/h5-8,12H,3-4,9-11H2,1-2H3