2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide CAS Name: 2-[(3S)-3-methyl-1-piperidin-1-iumyl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide IUPAC Name: 2-[(3S)-3-methylpiperidin-1-ium-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetamide Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)NC2=C(C=CC=C2C(C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O/c1-13(2)16-9-5-8-15(4)18(16)19-17(21)12-20-10-6-7-14(3)11-20/h5,8-9,13-14H,6-7,10-12H2,1-4H3,(H,19,21)/p+1/t14-/m0/s1