2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3S)-1-(phenylmethyl)piperidin-1-ium-3-yl]ethanamide Openeye Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-2-(3,5-dimethylisoxazol-4-yl)acetamide CAS Name: 2-(3,5-dimethyl-4-isoxazolyl)-N-[(3S)-1-(phenylmethyl)-3-piperidin-1-iumyl]acetamide IUPAC Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide Traditional Name: N-[(3S)-1-benzylpiperidin-1-ium-3-yl]-2-(3,5-dimethylisoxazol-4-yl)acetamide Formula: C19H26N3O2+ MolecularWeight: 328.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CC(=O)NC2CCC[NH+](C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)CC(=O)N[C@H]2CCC[NH+](C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3O2/c1-14-18(15(2)24-21-14)11-19(23)20-17-9-6-10-22(13-17)12-16-7-4-3-5-8-16/h3-5,7-8,17H,6,9-13H2,1-2H3,(H,20,23)/p+1/t17-/m0/s1