1-[4-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[[5-methyl-2-(3-phenoxyphenyl)oxazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[[5-methyl-2-(3-phenoxyphenyl)-4-oxazolyl]methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[[5-methyl-2-(3-phenoxyphenyl)oxazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Formula: C23H26N3O3+ MolecularWeight: 392.47084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=CC=C2)OC3=CC=CC=C3)C[NH+]4CCN(CC4)C(=O)C

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=CC=C2)OC3=CC=CC=C3)C[NH+]4CCN(CC4)C(=O)C

InChI

InChI=1S/C23H25N3O3/c1-17-22(16-25-11-13-26(14-12-25)18(2)27)24-23(28-17)19-7-6-10-21(15-19)29-20-8-4-3-5-9-20/h3-10,15H,11-14,16H2,1-2H3/p+1