2-[(4-tert-butylphenyl)methylsulfonyl]-1-(3,5-dimethylpiperidin-1-yl)propan-1-one

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfonyl]-1-(3,5-dimethylpiperidin-1-yl)propan-1-one Openeye Name: 2-[(4-tert-butylphenyl)methylsulfonyl]-1-(3,5-dimethyl-1-piperidyl)propan-1-one CAS Name: 2-[(4-tert-butylphenyl)methylsulfonyl]-1-(3,5-dimethyl-1-piperidinyl)-1-propanone IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfonyl]-1-(3,5-dimethylpiperidin-1-yl)propan-1-one Traditional Name: 2-(4-tert-butylbenzyl)sulfonyl-1-(3,5-dimethylpiperidino)propan-1-one Formula: C21H33NO3S MolecularWeight: 379.55662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C(C)S(=O)(=O)CC2=CC=C(C=C2)C(C)(C)C)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C(C)S(=O)(=O)CC2=CC=C(C=C2)C(C)(C)C)C

InChI

InChI=1S/C21H33NO3S/c1-15-11-16(2)13-22(12-15)20(23)17(3)26(24,25)14-18-7-9-19(10-8-18)21(4,5)6/h7-10,15-17H,11-14H2,1-6H3