3-methyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-5-propan-2-yl-1,2-oxazole-4-carboxamide

Systemtic Name: 3-methyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-5-propan-2-yl-1,2-oxazole-4-carboxamide Openeye Name: 5-isopropyl-3-methyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]isoxazole-4-carboxamide CAS Name: 3-methyl-N-[[4-[(4-methyl-1-piperidin-1-iumyl)methyl]phenyl]methyl]-5-propan-2-yl-4-isoxazolecarboxamide IUPAC Name: 3-methyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-5-propan-2-yl-1,2-oxazole-4-carboxamide Traditional Name: 5-isopropyl-3-methyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzyl]isoxazole-4-carboxamide Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=C(ON=C3C)C(C)C

Isomeric SMILES

CC1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=C(ON=C3C)C(C)C

InChI

InChI=1S/C22H31N3O2/c1-15(2)21-20(17(4)24-27-21)22(26)23-13-18-5-7-19(8-6-18)14-25-11-9-16(3)10-12-25/h5-8,15-16H,9-14H2,1-4H3,(H,23,26)/p+1