N-(2-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide

Systemtic Name: N-(2-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide Openeye Name: N-(2-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide CAS Name: N-(2-cyanophenyl)-3-[4-(4-hydroxyphenyl)-1-piperidin-1-iumyl]propanamide IUPAC Name: N-(2-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propanamide Traditional Name: N-(2-cyanophenyl)-3-[4-(4-hydroxyphenyl)piperidin-1-ium-1-yl]propionamide Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CC=C(C=C2)O)CCC(=O)NC3=CC=CC=C3C#N

Isomeric SMILES

C1C[NH+](CCC1C2=CC=C(C=C2)O)CCC(=O)NC3=CC=CC=C3C#N

InChI

InChI=1S/C21H23N3O2/c22-15-18-3-1-2-4-20(18)23-21(26)11-14-24-12-9-17(10-13-24)16-5-7-19(25)8-6-16/h1-8,17,25H,9-14H2,(H,23,26)/p+1