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

Systemtic Name: (2S)-2-(4-methylphenoxy)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)propanamide Openeye Name: (2S)-N-(1-isopropylpiperidin-1-ium-4-yl)-2-(4-methylphenoxy)propanamide CAS Name: (2S)-2-(4-methylphenoxy)-N-(1-propan-2-yl-4-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-2-(4-methylphenoxy)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)propanamide Traditional Name: (2S)-N-(1-isopropylpiperidin-1-ium-4-yl)-2-(4-methylphenoxy)propionamide Formula: C18H29N2O2+ MolecularWeight: 305.43506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(C)C(=O)NC2CC[NH+](CC2)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)O[C@@H](C)C(=O)NC2CC[NH+](CC2)C(C)C

InChI

InChI=1S/C18H28N2O2/c1-13(2)20-11-9-16(10-12-20)19-18(21)15(4)22-17-7-5-14(3)6-8-17/h5-8,13,15-16H,9-12H2,1-4H3,(H,19,21)/p+1/t15-/m0/s1