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1-[3-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]ethoxy]phenyl]ethanone
1-[3-[2-[4-(1,3-benzothiazol-2-yl)piperidin-1-ium-1-yl]ethoxy]phenyl]ethanone
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Descriptors Computed from Structure
Canonical SMILES:
CC(=O)C1=CC(=CC=C1)OCC[NH+]2CCC(CC2)C3=NC4=CC=CC=C4S3
Isomeric SMILES
CC(=O)C1=CC(=CC=C1)OCC[NH+]2CCC(CC2)C3=NC4=CC=CC=C4S3
InChI
InChI=1S/C22H24N2O2S/c1-16(25)18-5-4-6-19(15-18)26-14-13-24-11-9-17(10-12-24)22-23-20-7-2-3-8-21(20)27-22/h2-8,15,17H,9-14H2,1H3/p+1
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