3-methyl-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-4-phenyl-1,2-oxazol-5-amine

Systemtic Name: 3-methyl-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-4-phenyl-1,2-oxazol-5-amine Openeye Name: 3-methyl-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-4-phenyl-isoxazol-5-amine CAS Name: 3-methyl-N-[(1-methyl-4-piperidin-1-iumyl)methyl]-4-phenyl-5-isoxazolamine IUPAC Name: 3-methyl-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-4-phenyl-1,2-oxazol-5-amine Traditional Name: (3-methyl-4-phenyl-isoxazol-5-yl)-[(1-methylpiperidin-1-ium-4-yl)methyl]amine Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C2=CC=CC=C2)NCC3CC[NH+](CC3)C

Isomeric SMILES

CC1=NOC(=C1C2=CC=CC=C2)NCC3CC[NH+](CC3)C

InChI

InChI=1S/C17H23N3O/c1-13-16(15-6-4-3-5-7-15)17(21-19-13)18-12-14-8-10-20(2)11-9-14/h3-7,14,18H,8-12H2,1-2H3/p+1