N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-yl-ethyl]ethanesulfonamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-yl-ethyl]ethanesulfonamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-(3-pyridyl)ethyl]ethanesulfonamide CAS Name: N-[2-(4-phenyl-1-piperazin-1-iumyl)-2-(3-pyridinyl)ethyl]ethanesulfonamide IUPAC Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-ylethyl]ethanesulfonamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-(3-pyridyl)ethyl]ethanesulfonamide Formula: C19H27N4O2S+ MolecularWeight: 375.50828

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NCC(C1=CN=CC=C1)[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)NCC(C1=CN=CC=C1)[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H26N4O2S/c1-2-26(24,25)21-16-19(17-7-6-10-20-15-17)23-13-11-22(12-14-23)18-8-4-3-5-9-18/h3-10,15,19,21H,2,11-14,16H2,1H3/p+1