[(2R)-2-[[1-(4-cyanophenyl)sulfonylpiperidin-4-yl]carbonylamino]-2-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(2R)-2-[[1-(4-cyanophenyl)sulfonylpiperidin-4-yl]carbonylamino]-2-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(2R)-2-[[1-(4-cyanophenyl)sulfonylpiperidine-4-carbonyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(2R)-2-[[[1-(4-cyanophenyl)sulfonyl-4-piperidinyl]-oxomethyl]amino]-2-phenylethyl]-dimethylammonium IUPAC Name: [(2R)-2-[[1-(4-cyanophenyl)sulfonylpiperidine-4-carbonyl]amino]-2-phenylethyl]-dimethylazanium Traditional Name: [(2R)-2-[[1-(4-cyanophenyl)sulfonylisonipecotoyl]amino]-2-phenyl-ethyl]-dimethyl-ammonium Formula: C23H29N4O3S+ MolecularWeight: 441.56636

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(C1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C[NH+](C)C[C@@H](C1=CC=CC=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H28N4O3S/c1-26(2)17-22(19-6-4-3-5-7-19)25-23(28)20-12-14-27(15-13-20)31(29,30)21-10-8-18(16-24)9-11-21/h3-11,20,22H,12-15,17H2,1-2H3,(H,25,28)/p+1/t22-/m0/s1