(2S)-2-piperidin-1-ium-1-yl-N-(2-propan-2-ylphenyl)propanamide

Systemtic Name: (2S)-2-piperidin-1-ium-1-yl-N-(2-propan-2-ylphenyl)propanamide Openeye Name: (2S)-N-(2-isopropylphenyl)-2-piperidin-1-ium-1-yl-propanamide CAS Name: (2S)-2-(1-piperidin-1-iumyl)-N-(2-propan-2-ylphenyl)propanamide IUPAC Name: (2S)-2-piperidin-1-ium-1-yl-N-(2-propan-2-ylphenyl)propanamide Traditional Name: (2S)-N-o-cumenyl-2-piperidin-1-ium-1-yl-propionamide Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C(C)[NH+]2CCCCC2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1C(C)C)[NH+]2CCCCC2

InChI

InChI=1S/C17H26N2O/c1-13(2)15-9-5-6-10-16(15)18-17(20)14(3)19-11-7-4-8-12-19/h5-6,9-10,13-14H,4,7-8,11-12H2,1-3H3,(H,18,20)/p+1/t14-/m0/s1