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4-cyano-N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide
4-cyano-N-[2-methyl-2-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propyl]benzamide
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)(CNC(=O)C1=CC=C(C=C1)C#N)[NH+]2CCC3=CC=CC=C3C2
Isomeric SMILES
CC(C)(CNC(=O)C1=CC=C(C=C1)C#N)[NH+]2CCC3=CC=CC=C3C2
InChI
InChI=1S/C21H23N3O/c1-21(2,24-12-11-17-5-3-4-6-19(17)14-24)15-23-20(25)18-9-7-16(13-22)8-10-18/h3-10H,11-12,14-15H2,1-2H3,(H,23,25)/p+1
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- N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]-3-morpholin-4-ylsulfonyl-benzamide
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