(4-chlorophenyl)methyl-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]-methyl-azanium

Systemtic Name: (4-chlorophenyl)methyl-[(3,5-dimethyl-4-piperidin-1-ylsulfonyl-pyrazol-1-yl)methyl]-methyl-azanium Openeye Name: (4-chlorophenyl)methyl-[[3,5-dimethyl-4-(1-piperidylsulfonyl)pyrazol-1-yl]methyl]-methyl-ammonium CAS Name: (4-chlorophenyl)methyl-[[3,5-dimethyl-4-(1-piperidinylsulfonyl)-1-pyrazolyl]methyl]-methylammonium IUPAC Name: (4-chlorophenyl)methyl-[(3,5-dimethyl-4-piperidin-1-ylsulfonylpyrazol-1-yl)methyl]-methylazanium Traditional Name: (4-chlorobenzyl)-[(3,5-dimethyl-4-piperidinosulfonyl-pyrazol-1-yl)methyl]-methyl-ammonium Formula: C19H28ClN4O2S+ MolecularWeight: 411.96922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C[NH+](C)CC2=CC=C(C=C2)Cl)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=NN1C[NH+](C)CC2=CC=C(C=C2)Cl)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H27ClN4O2S/c1-15-19(27(25,26)23-11-5-4-6-12-23)16(2)24(21-15)14-22(3)13-17-7-9-18(20)10-8-17/h7-10H,4-6,11-14H2,1-3H3/p+1