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

Systemtic Name: (2R)-N-(3-cyanophenyl)-2-[4-(phenylmethyl)piperidin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(3-cyanophenyl)propanamide CAS Name: (2R)-N-(3-cyanophenyl)-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]propanamide IUPAC Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(3-cyanophenyl)propanamide Traditional Name: (2R)-2-(4-benzylpiperidin-1-ium-1-yl)-N-(3-cyanophenyl)propionamide Formula: C22H26N3O+ MolecularWeight: 348.46134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C#N)[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O/c1-17(22(26)24-21-9-5-8-20(15-21)16-23)25-12-10-19(11-13-25)14-18-6-3-2-4-7-18/h2-9,15,17,19H,10-14H2,1H3,(H,24,26)/p+1/t17-/m1/s1