(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)methylazanium

Systemtic Name: (4-methyl-3-piperidin-1-ylsulfonyl-phenyl)methylazanium Openeye Name: [4-methyl-3-(1-piperidylsulfonyl)phenyl]methylammonium CAS Name: [4-methyl-3-(1-piperidinylsulfonyl)phenyl]methylammonium IUPAC Name: (4-methyl-3-piperidin-1-ylsulfonylphenyl)methylazanium Traditional Name: (4-methyl-3-piperidinosulfonyl-benzyl)ammonium Formula: C13H21N2O2S+ MolecularWeight: 269.38304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH3+])S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C13H20N2O2S/c1-11-5-6-12(10-14)9-13(11)18(16,17)15-7-3-2-4-8-15/h5-6,9H,2-4,7-8,10,14H2,1H3/p+1