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2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-yl]pyridin-1-ium-3-carbonitrile
2-[4-[3-(2-hydroxyphenyl)propanoyl]piperazin-1-yl]pyridin-1-ium-3-carbonitrile
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Descriptors Computed from Structure
Canonical SMILES:
C1CN(CCN1C2=C(C=CC=[NH+]2)C#N)C(=O)CCC3=CC=CC=C3O
Isomeric SMILES
C1CN(CCN1C2=C(C=CC=[NH+]2)C#N)C(=O)CCC3=CC=CC=C3O
InChI
InChI=1S/C19H20N4O2/c20-14-16-5-3-9-21-19(16)23-12-10-22(11-13-23)18(25)8-7-15-4-1-2-6-17(15)24/h1-6,9,24H,7-8,10-13H2/p+1
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