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

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-[(2S)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(2,5-dimethoxyphenyl)-2-[(2S)-2-(5-methylisoxazol-3-yl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[(2S)-2-(5-methyl-3-isoxazolyl)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-[(2S)-2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(2,5-dimethoxyphenyl)-2-[(2S)-2-(5-methylisoxazol-3-yl)pyrrolidin-1-ium-1-yl]acetamide Formula: C18H24N3O4+ MolecularWeight: 346.40086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C2CCC[NH+]2CC(=O)NC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC(=NO1)[C@@H]2CCC[NH+]2CC(=O)NC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C18H23N3O4/c1-12-9-14(20-25-12)16-5-4-8-21(16)11-18(22)19-15-10-13(23-2)6-7-17(15)24-3/h6-7,9-10,16H,4-5,8,11H2,1-3H3,(H,19,22)/p+1/t16-/m0/s1