1-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperidin-1-ium-1-yl)piperidine

Systemtic Name: 1-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperidin-1-ium-1-yl)piperidine Openeye Name: 1-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperidin-1-ium-1-yl)piperidine CAS Name: 1-(4-tert-butylphenyl)sulfonyl-4-(4-methyl-1-piperidin-1-iumyl)piperidine IUPAC Name: 1-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperidin-1-ium-1-yl)piperidine Traditional Name: 1-(4-tert-butylphenyl)sulfonyl-4-(4-methylpiperidin-1-ium-1-yl)piperidine Formula: C21H35N2O2S+ MolecularWeight: 379.5798

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1CC[NH+](CC1)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H34N2O2S/c1-17-9-13-22(14-10-17)19-11-15-23(16-12-19)26(24,25)20-7-5-18(6-8-20)21(2,3)4/h5-8,17,19H,9-16H2,1-4H3/p+1