N-[(1R,2S)-2-methylcyclohexyl]-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(1R,2S)-2-methylcyclohexyl]-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-[(1R,2S)-2-methylcyclohexyl]-2-[(2R)-2-(5-methylisoxazol-3-yl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-[(1R,2S)-2-methylcyclohexyl]-2-[(2R)-2-(5-methyl-3-isoxazolyl)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[(1R,2S)-2-methylcyclohexyl]-2-[(2R)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-[(1R,2S)-2-methylcyclohexyl]-2-[(2R)-2-(5-methylisoxazol-3-yl)pyrrolidin-1-ium-1-yl]acetamide Formula: C17H28N3O2+ MolecularWeight: 306.42312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C[NH+]2CCCC2C3=NOC(=C3)C

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)C[NH+]2CCC[C@@H]2C3=NOC(=C3)C

InChI

InChI=1S/C17H27N3O2/c1-12-6-3-4-7-14(12)18-17(21)11-20-9-5-8-16(20)15-10-13(2)22-19-15/h10,12,14,16H,3-9,11H2,1-2H3,(H,18,21)/p+1/t12-,14+,16+/m0/s1