(2S)-2-(2-methylphenoxy)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)butanamide

Systemtic Name: (2S)-2-(2-methylphenoxy)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)butanamide Openeye Name: (2S)-N-(1-isopropylpiperidin-1-ium-4-yl)-2-(2-methylphenoxy)butanamide CAS Name: (2S)-2-(2-methylphenoxy)-N-(1-propan-2-yl-4-piperidin-1-iumyl)butanamide IUPAC Name: (2S)-2-(2-methylphenoxy)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)butanamide Traditional Name: (2S)-N-(1-isopropylpiperidin-1-ium-4-yl)-2-(2-methylphenoxy)butyramide Formula: C19H31N2O2+ MolecularWeight: 319.46164

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CC[NH+](CC1)C(C)C)OC2=CC=CC=C2C

Isomeric SMILES

CC[C@@H](C(=O)NC1CC[NH+](CC1)C(C)C)OC2=CC=CC=C2C

InChI

InChI=1S/C19H30N2O2/c1-5-17(23-18-9-7-6-8-15(18)4)19(22)20-16-10-12-21(13-11-16)14(2)3/h6-9,14,16-17H,5,10-13H2,1-4H3,(H,20,22)/p+1/t17-/m0/s1