[4-[5-(aminomethyl)-1-ethylsulfonyl-2H-pyridin-1-ium-1-yl]phenyl]methanol

Systemtic Name: [4-[5-(aminomethyl)-1-ethylsulfonyl-2H-pyridin-1-ium-1-yl]phenyl]methanol Openeye Name: [4-[5-(aminomethyl)-1-ethylsulfonyl-2H-pyridin-1-ium-1-yl]phenyl]methanol CAS Name: [4-[5-(aminomethyl)-1-ethylsulfonyl-2H-pyridin-1-ium-1-yl]phenyl]methanol IUPAC Name: [4-[5-(aminomethyl)-1-ethylsulfonyl-2H-pyridin-1-ium-1-yl]phenyl]methanol Traditional Name: [4-[5-(aminomethyl)-1-esyl-2H-pyridin-1-ium-1-yl]phenyl]methanol Formula: C15H21N2O3S+ MolecularWeight: 309.40384

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=C(C=C2)CO

Isomeric SMILES

CCS(=O)(=O)[N+]1(CC=CC(=C1)CN)C2=CC=C(C=C2)CO

InChI

InChI=1S/C15H21N2O3S/c1-2-21(19,20)17(9-3-4-14(10-16)11-17)15-7-5-13(12-18)6-8-15/h3-8,11,18H,2,9-10,12,16H2,1H3/q+1