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

Systemtic Name: 4-[[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-1-phenyl-piperazin-4-ium-2-one Openeye Name: 4-[[2-(2-chlorophenyl)-5-methyl-oxazol-4-yl]methyl]-1-phenyl-piperazin-4-ium-2-one CAS Name: 4-[[2-(2-chlorophenyl)-5-methyl-4-oxazolyl]methyl]-1-phenyl-2-piperazin-4-iumone IUPAC Name: 4-[[2-(2-chlorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-1-phenylpiperazin-4-ium-2-one Traditional Name: 4-[[2-(2-chlorophenyl)-5-methyl-oxazol-4-yl]methyl]-1-phenyl-piperazin-4-ium-2-one Formula: C21H21ClN3O2+ MolecularWeight: 382.86334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2Cl)C[NH+]3CCN(C(=O)C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2Cl)C[NH+]3CCN(C(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C21H20ClN3O2/c1-15-19(23-21(27-15)17-9-5-6-10-18(17)22)13-24-11-12-25(20(26)14-24)16-7-3-2-4-8-16/h2-10H,11-14H2,1H3/p+1