methyl 3-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-methyl-benzoate

Systemtic Name: methyl 3-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-methyl-benzoate Openeye Name: methyl 3-[(3,5-dimethyl-1-piperidyl)sulfonyl]-4-methyl-benzoate CAS Name: 3-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-(3,5-dimethylpiperidin-1-yl)sulfonyl-4-methylbenzoate Traditional Name: 3-(3,5-dimethylpiperidino)sulfonyl-4-methyl-benzoic acid methyl ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC)C)C

InChI

InChI=1S/C16H23NO4S/c1-11-7-12(2)10-17(9-11)22(19,20)15-8-14(16(18)21-4)6-5-13(15)3/h5-6,8,11-12H,7,9-10H2,1-4H3