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

Systemtic Name: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(3,5-dimethylisoxazol-4-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(3,5-dimethyl-4-isoxazolyl)-N-[(2S)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(3,5-dimethylisoxazol-4-yl)-N-[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide Formula: C21H30N3O3+ MolecularWeight: 372.4812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O3/c1-15-19(16(2)27-23-15)13-21(25)22-14-20(24-11-5-4-6-12-24)17-7-9-18(26-3)10-8-17/h7-10,20H,4-6,11-14H2,1-3H3,(H,22,25)/p+1/t20-/m1/s1