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methyl-phenethyl-[(3S)-1-pyridin-3-ylsulfonylpiperidin-3-yl]azanium

methyl-phenethyl-[(3S)-1-pyridin-3-ylsulfonylpiperidin-3-yl]azanium

Systemtic Name:methyl-phenethyl-[(3S)-1-pyridin-3-ylsulfonylpiperidin-3-yl]azanium
Openeye Name:methyl-phenethyl-[(3S)-1-(3-pyridylsulfonyl)-3-piperidyl]ammonium
CAS Name:methyl-phenethyl-[(3S)-1-(3-pyridinylsulfonyl)-3-piperidinyl]ammonium
IUPAC Name:methyl-phenethyl-[(3S)-1-pyridin-3-ylsulfonylpiperidin-3-yl]azanium
Traditional Name:methyl-phenethyl-[(3S)-1-(3-pyridylsulfonyl)-3-piperidyl]ammonium
Formula: C19H26N3O2S+
MolecularWeight: 360.49364
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCCN(C2)S(=O)(=O)C3=CN=CC=C3


Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@H]2CCCN(C2)S(=O)(=O)C3=CN=CC=C3


InChI

InChI=1S/C19H25N3O2S/c1-21(14-11-17-7-3-2-4-8-17)18-9-6-13-22(16-18)25(23,24)19-10-5-12-20-15-19/h2-5,7-8,10,12,15,18H,6,9,11,13-14,16H2,1H3/p+1/t18-/m0/s1


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