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2-cyano-N-[2-[3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]ethyl]ethanamide
2-cyano-N-[2-[3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]ethyl]ethanamide
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC=CC(=C1OCC[NH+]2CCCC2)CCNC(=O)CC#N
Isomeric SMILES
COC1=CC=CC(=C1OCC[NH+]2CCCC2)CCNC(=O)CC#N
InChI
InChI=1S/C18H25N3O3/c1-23-16-6-4-5-15(8-10-20-17(22)7-9-19)18(16)24-14-13-21-11-2-3-12-21/h4-6H,2-3,7-8,10-14H2,1H3,(H,20,22)/p+1
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