5-[(3,4-dimethylphenoxy)methyl]-N-methyl-N-[[(3R)-1-propan-2-ylpyrrolidin-1-ium-3-yl]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-[(3,4-dimethylphenoxy)methyl]-N-methyl-N-[[(3R)-1-propan-2-ylpyrrolidin-1-ium-3-yl]methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-[(3,4-dimethylphenoxy)methyl]-N-[[(3R)-1-isopropylpyrrolidin-1-ium-3-yl]methyl]-N-methyl-isoxazole-3-carboxamide CAS Name: 5-[(3,4-dimethylphenoxy)methyl]-N-methyl-N-[[(3R)-1-propan-2-yl-3-pyrrolidin-1-iumyl]methyl]-3-isoxazolecarboxamide IUPAC Name: 5-[(3,4-dimethylphenoxy)methyl]-N-methyl-N-[[(3R)-1-propan-2-ylpyrrolidin-1-ium-3-yl]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[(3,4-dimethylphenoxy)methyl]-N-[[(3R)-1-isopropylpyrrolidin-1-ium-3-yl]methyl]-N-methyl-isoxazole-3-carboxamide Formula: C22H32N3O3+ MolecularWeight: 386.50778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC2=CC(=NO2)C(=O)N(C)CC3CC[NH+](C3)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC2=CC(=NO2)C(=O)N(C)C[C@H]3CC[NH+](C3)C(C)C)C

InChI

InChI=1S/C22H31N3O3/c1-15(2)25-9-8-18(13-25)12-24(5)22(26)21-11-20(28-23-21)14-27-19-7-6-16(3)17(4)10-19/h6-7,10-11,15,18H,8-9,12-14H2,1-5H3/p+1/t18-/m1/s1