ethyl-(pyridin-4-ylmethyl)-[(3S)-1-pyridin-3-ylsulfonylpiperidin-3-yl]azanium

Systemtic Name: ethyl-(pyridin-4-ylmethyl)-[(3S)-1-pyridin-3-ylsulfonylpiperidin-3-yl]azanium Openeye Name: ethyl-(4-pyridylmethyl)-[(3S)-1-(3-pyridylsulfonyl)-3-piperidyl]ammonium CAS Name: ethyl-(pyridin-4-ylmethyl)-[(3S)-1-(3-pyridinylsulfonyl)-3-piperidinyl]ammonium IUPAC Name: ethyl-(pyridin-4-ylmethyl)-[(3S)-1-pyridin-3-ylsulfonylpiperidin-3-yl]azanium Traditional Name: ethyl-(4-pyridylmethyl)-[(3S)-1-(3-pyridylsulfonyl)-3-piperidyl]ammonium Formula: C18H25N4O2S+ MolecularWeight: 361.4817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=NC=C1)C2CCCN(C2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC[NH+](CC1=CC=NC=C1)[C@H]2CCCN(C2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H24N4O2S/c1-2-21(14-16-7-10-19-11-8-16)17-5-4-12-22(15-17)25(23,24)18-6-3-9-20-13-18/h3,6-11,13,17H,2,4-5,12,14-15H2,1H3/p+1/t17-/m0/s1