(2S)-2-[4-(4-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]-N-propyl-propanamide

Systemtic Name: (2S)-2-[4-(4-methoxyphenyl)carbonylpiperidin-1-ium-1-yl]-N-propyl-propanamide Openeye Name: (2S)-2-[4-(4-methoxybenzoyl)piperidin-1-ium-1-yl]-N-propyl-propanamide CAS Name: (2S)-2-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperidin-1-iumyl]-N-propylpropanamide IUPAC Name: (2S)-2-[4-(4-methoxybenzoyl)piperidin-1-ium-1-yl]-N-propylpropanamide Traditional Name: (2S)-2-(4-p-anisoylpiperidin-1-ium-1-yl)-N-propyl-propionamide Formula: C19H29N2O3+ MolecularWeight: 333.44516

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)[NH+]1CCC(CC1)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCNC(=O)[C@H](C)[NH+]1CCC(CC1)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H28N2O3/c1-4-11-20-19(23)14(2)21-12-9-16(10-13-21)18(22)15-5-7-17(24-3)8-6-15/h5-8,14,16H,4,9-13H2,1-3H3,(H,20,23)/p+1/t14-/m0/s1