[(1R)-1-(3-methoxyphenyl)-2-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(3-methoxyphenyl)-2-[(1-pyridin-3-ylsulfonylpiperidin-4-yl)carbonylamino]ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(3-methoxyphenyl)-2-[[1-(3-pyridylsulfonyl)piperidine-4-carbonyl]amino]ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(3-methoxyphenyl)-2-[[oxo-[1-(3-pyridinylsulfonyl)-4-piperidinyl]methyl]amino]ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(3-methoxyphenyl)-2-[(1-pyridin-3-ylsulfonylpiperidine-4-carbonyl)amino]ethyl]-dimethylazanium Traditional Name: [(1R)-1-(3-methoxyphenyl)-2-[[1-(3-pyridylsulfonyl)isonipecotoyl]amino]ethyl]-dimethyl-ammonium Formula: C22H31N4O4S+ MolecularWeight: 447.57094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CN=CC=C2)C3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CN=CC=C2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H30N4O4S/c1-25(2)21(18-6-4-7-19(14-18)30-3)16-24-22(27)17-9-12-26(13-10-17)31(28,29)20-8-5-11-23-15-20/h4-8,11,14-15,17,21H,9-10,12-13,16H2,1-3H3,(H,24,27)/p+1/t21-/m0/s1