(2S)-2-(4-tert-butylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propanamide

Systemtic Name: (2S)-2-(4-tert-butylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propanamide Openeye Name: (2S)-2-(4-tert-butylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propanamide CAS Name: (2S)-2-(4-tert-butylphenoxy)-N-(1-ethyl-4-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-2-(4-tert-butylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propanamide Traditional Name: (2S)-2-(4-tert-butylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propionamide Formula: C20H33N2O2+ MolecularWeight: 333.48822

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)C(C)OC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)[C@H](C)OC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H32N2O2/c1-6-22-13-11-17(12-14-22)21-19(23)15(2)24-18-9-7-16(8-10-18)20(3,4)5/h7-10,15,17H,6,11-14H2,1-5H3,(H,21,23)/p+1/t15-/m0/s1