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

Systemtic Name: N-(4-cyanophenyl)-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Openeye Name: N-(4-cyanophenyl)-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide CAS Name: N-(4-cyanophenyl)-3-[(3S)-3-methyl-1-piperidin-1-iumyl]propanamide IUPAC Name: N-(4-cyanophenyl)-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propanamide Traditional Name: N-(4-cyanophenyl)-3-[(3S)-3-methylpiperidin-1-ium-1-yl]propionamide Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCC(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CCC(=O)NC2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H21N3O/c1-13-3-2-9-19(12-13)10-8-16(20)18-15-6-4-14(11-17)5-7-15/h4-7,13H,2-3,8-10,12H2,1H3,(H,18,20)/p+1/t13-/m0/s1