[(3S)-1-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: [(3S)-1-(5-chloranyl-2-methoxy-phenyl)sulfonylpiperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: [(3S)-1-(5-chloro-2-methoxy-phenyl)sulfonyl-3-piperidyl]-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: [(3S)-1-(5-chloro-2-methoxyphenyl)sulfonyl-3-piperidinyl]-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: [(3S)-1-(5-chloro-2-methoxyphenyl)sulfonylpiperidin-3-yl]-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: [(3S)-1-(5-chloro-2-methoxy-phenyl)sulfonyl-3-piperidyl]-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C20H27ClN3O3S+ MolecularWeight: 424.96468

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=N1)C2CCCN(C2)S(=O)(=O)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

C[NH+](CCC1=CC=CC=N1)[C@H]2CCCN(C2)S(=O)(=O)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H26ClN3O3S/c1-23(13-10-17-6-3-4-11-22-17)18-7-5-12-24(15-18)28(25,26)20-14-16(21)8-9-19(20)27-2/h3-4,6,8-9,11,14,18H,5,7,10,12-13,15H2,1-2H3/p+1/t18-/m0/s1