4-[4-(phenylmethyl)piperidin-1-yl]sulfonylbutylazanium

Systemtic Name: 4-[4-(phenylmethyl)piperidin-1-yl]sulfonylbutylazanium Openeye Name: 4-[(4-benzyl-1-piperidyl)sulfonyl]butylammonium CAS Name: 4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]butylammonium IUPAC Name: 4-(4-benzylpiperidin-1-yl)sulfonylbutylazanium Traditional Name: 4-(4-benzylpiperidino)sulfonylbutylammonium Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)CCCC[NH3+]

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)CCCC[NH3+]

InChI

InChI=1S/C16H26N2O2S/c17-10-4-5-13-21(19,20)18-11-8-16(9-12-18)14-15-6-2-1-3-7-15/h1-3,6-7,16H,4-5,8-14,17H2/p+1