(2S)-2-piperidin-1-ium-1-yl-N-(2,4,6-trimethylphenyl)propanamide

Systemtic Name: (2S)-2-piperidin-1-ium-1-yl-N-(2,4,6-trimethylphenyl)propanamide Openeye Name: (2S)-2-piperidin-1-ium-1-yl-N-(2,4,6-trimethylphenyl)propanamide CAS Name: (2S)-2-(1-piperidin-1-iumyl)-N-(2,4,6-trimethylphenyl)propanamide IUPAC Name: (2S)-2-piperidin-1-ium-1-yl-N-(2,4,6-trimethylphenyl)propanamide Traditional Name: (2S)-N-mesityl-2-piperidin-1-ium-1-yl-propionamide Formula: C17H27N2O+ MolecularWeight: 275.40908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C(C)[NH+]2CCCCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)[C@H](C)[NH+]2CCCCC2)C

InChI

InChI=1S/C17H26N2O/c1-12-10-13(2)16(14(3)11-12)18-17(20)15(4)19-8-6-5-7-9-19/h10-11,15H,5-9H2,1-4H3,(H,18,20)/p+1/t15-/m0/s1