4-[[2-(2,4-dimethoxy-3-methyl-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-1-phenyl-piperazin-4-ium-2-one

Systemtic Name: 4-[[2-(2,4-dimethoxy-3-methyl-phenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-1-phenyl-piperazin-4-ium-2-one Openeye Name: 4-[[2-(2,4-dimethoxy-3-methyl-phenyl)-5-methyl-oxazol-4-yl]methyl]-1-phenyl-piperazin-4-ium-2-one CAS Name: 4-[[2-(2,4-dimethoxy-3-methylphenyl)-5-methyl-4-oxazolyl]methyl]-1-phenyl-2-piperazin-4-iumone IUPAC Name: 4-[[2-(2,4-dimethoxy-3-methylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-1-phenylpiperazin-4-ium-2-one Traditional Name: 4-[[2-(2,4-dimethoxy-3-methyl-phenyl)-5-methyl-oxazol-4-yl]methyl]-1-phenyl-piperazin-4-ium-2-one Formula: C24H28N3O4+ MolecularWeight: 422.49682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1OC)C2=NC(=C(O2)C)C[NH+]3CCN(C(=O)C3)C4=CC=CC=C4)OC

Isomeric SMILES

CC1=C(C=CC(=C1OC)C2=NC(=C(O2)C)C[NH+]3CCN(C(=O)C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H27N3O4/c1-16-21(29-3)11-10-19(23(16)30-4)24-25-20(17(2)31-24)14-26-12-13-27(22(28)15-26)18-8-6-5-7-9-18/h5-11H,12-15H2,1-4H3/p+1