N-(2-cyanophenyl)-4-[(3S)-3-methylpiperidin-1-ium-1-yl]butanamide

Systemtic Name: N-(2-cyanophenyl)-4-[(3S)-3-methylpiperidin-1-ium-1-yl]butanamide Openeye Name: N-(2-cyanophenyl)-4-[(3S)-3-methylpiperidin-1-ium-1-yl]butanamide CAS Name: N-(2-cyanophenyl)-4-[(3S)-3-methyl-1-piperidin-1-iumyl]butanamide IUPAC Name: N-(2-cyanophenyl)-4-[(3S)-3-methylpiperidin-1-ium-1-yl]butanamide Traditional Name: N-(2-cyanophenyl)-4-[(3S)-3-methylpiperidin-1-ium-1-yl]butyramide Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCCC(=O)NC2=CC=CC=C2C#N

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCCC(=O)NC2=CC=CC=C2C#N

InChI

InChI=1S/C17H23N3O/c1-14-6-4-10-20(13-14)11-5-9-17(21)19-16-8-3-2-7-15(16)12-18/h2-3,7-8,14H,4-6,9-11,13H2,1H3,(H,19,21)/p+1/t14-/m0/s1