(5-methyl-3-phenyl-1,2-oxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-methyl-3-phenyl-1,2-oxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-methyl-3-phenyl-isoxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (5-methyl-3-phenyl-4-isoxazolyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-methyl-3-phenyl-1,2-oxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-methyl-3-phenyl-isoxazol-4-yl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C16H20N3O2+ MolecularWeight: 286.3489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C16H19N3O2/c1-12-14(16(20)19-10-8-18(2)9-11-19)15(17-21-12)13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3/p+1