(2S)-2-(2,4-dimethylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propanamide

Systemtic Name: (2S)-2-(2,4-dimethylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propanamide Openeye Name: (2S)-2-(2,4-dimethylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propanamide CAS Name: (2S)-2-(2,4-dimethylphenoxy)-N-(1-ethyl-4-piperidin-1-iumyl)propanamide IUPAC Name: (2S)-2-(2,4-dimethylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propanamide Traditional Name: (2S)-2-(2,4-dimethylphenoxy)-N-(1-ethylpiperidin-1-ium-4-yl)propionamide Formula: C18H29N2O2+ MolecularWeight: 305.43506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O2/c1-5-20-10-8-16(9-11-20)19-18(21)15(4)22-17-7-6-13(2)12-14(17)3/h6-7,12,15-16H,5,8-11H2,1-4H3,(H,19,21)/p+1/t15-/m0/s1