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

Systemtic Name: 1-cyclohexyl-4-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperazin-4-ium-2-one Openeye Name: 1-cyclohexyl-4-[[2-(2-methoxyphenyl)-5-methyl-oxazol-4-yl]methyl]piperazin-4-ium-2-one CAS Name: 1-cyclohexyl-4-[[2-(2-methoxyphenyl)-5-methyl-4-oxazolyl]methyl]-2-piperazin-4-iumone IUPAC Name: 1-cyclohexyl-4-[[2-(2-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperazin-4-ium-2-one Traditional Name: 1-cyclohexyl-4-[[2-(2-methoxyphenyl)-5-methyl-oxazol-4-yl]methyl]piperazin-4-ium-2-one Formula: C22H30N3O3+ MolecularWeight: 384.4919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2OC)C[NH+]3CCN(C(=O)C3)C4CCCCC4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2OC)C[NH+]3CCN(C(=O)C3)C4CCCCC4

InChI

InChI=1S/C22H29N3O3/c1-16-19(23-22(28-16)18-10-6-7-11-20(18)27-2)14-24-12-13-25(21(26)15-24)17-8-4-3-5-9-17/h6-7,10-11,17H,3-5,8-9,12-15H2,1-2H3/p+1