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

Systemtic Name: 4-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]piperazin-4-ium-2-one Openeye Name: 4-[[5-methyl-2-(p-tolyl)oxazol-4-yl]methyl]piperazin-4-ium-2-one CAS Name: 4-[[5-methyl-2-(4-methylphenyl)-4-oxazolyl]methyl]-2-piperazin-4-iumone IUPAC Name: 4-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]piperazin-4-ium-2-one Traditional Name: 4-[[5-methyl-2-(p-tolyl)oxazol-4-yl]methyl]piperazin-4-ium-2-one Formula: C16H20N3O2+ MolecularWeight: 286.3489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(O2)C)C[NH+]3CCNC(=O)C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(O2)C)C[NH+]3CCNC(=O)C3

InChI

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