(2S)-N-cyclopropyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-ethanamide

Systemtic Name: (2S)-N-cyclopropyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-ethanamide Openeye Name: (2S)-N-cyclopropyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-acetamide CAS Name: (2S)-N-cyclopropyl-2-[(3S)-3-methyl-1-piperidin-1-iumyl]-2-phenylacetamide IUPAC Name: (2S)-N-cyclopropyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenylacetamide Traditional Name: (2S)-N-cyclopropyl-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-phenyl-acetamide Formula: C17H25N2O+ MolecularWeight: 273.3932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C2=CC=CC=C2)C(=O)NC3CC3

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C2=CC=CC=C2)C(=O)NC3CC3

InChI

InChI=1S/C17H24N2O/c1-13-6-5-11-19(12-13)16(14-7-3-2-4-8-14)17(20)18-15-9-10-15/h2-4,7-8,13,15-16H,5-6,9-12H2,1H3,(H,18,20)/p+1/t13-,16-/m0/s1