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

Systemtic Name: (5-methyl-3-phenyl-1,2-oxazol-4-yl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-allylpiperazin-4-ium-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)methanone CAS Name: (5-methyl-3-phenyl-4-isoxazolyl)-(4-prop-2-enyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-methyl-3-phenyl-1,2-oxazol-4-yl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-allylpiperazin-4-ium-1-yl)-(5-methyl-3-phenyl-isoxazol-4-yl)methanone Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O2/c1-3-9-20-10-12-21(13-11-20)18(22)16-14(2)23-19-17(16)15-7-5-4-6-8-15/h3-8H,1,9-13H2,2H3/p+1