3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]propanamide

Systemtic Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]propanamide Openeye Name: 3-(3,5-dimethylisoxazol-4-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]propanamide CAS Name: 3-(3,5-dimethyl-4-isoxazolyl)-N-[(2S)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]propanamide IUPAC Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]propanamide Traditional Name: 3-(3,5-dimethylisoxazol-4-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]propionamide Formula: C22H32N3O3+ MolecularWeight: 386.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)NCC(C2=CC=C(C=C2)OC)[NH+]3CCCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)NC[C@H](C2=CC=C(C=C2)OC)[NH+]3CCCCC3

InChI

InChI=1S/C22H31N3O3/c1-16-20(17(2)28-24-16)11-12-22(26)23-15-21(25-13-5-4-6-14-25)18-7-9-19(27-3)10-8-18/h7-10,21H,4-6,11-15H2,1-3H3,(H,23,26)/p+1/t21-/m1/s1