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

Systemtic Name: 4-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(3-methylphenyl)-1,3-oxazole Openeye Name: 4-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(m-tolyl)oxazole CAS Name: 4-[[4-(3-chlorophenyl)-1-piperazin-1-iumyl]methyl]-5-methyl-2-(3-methylphenyl)oxazole IUPAC Name: 4-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(3-methylphenyl)-1,3-oxazole Traditional Name: 4-[[4-(3-chlorophenyl)piperazin-1-ium-1-yl]methyl]-5-methyl-2-(m-tolyl)oxazole Formula: C22H25ClN3O+ MolecularWeight: 382.9064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(O2)C)C[NH+]3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H24ClN3O/c1-16-5-3-6-18(13-16)22-24-21(17(2)27-22)15-25-9-11-26(12-10-25)20-8-4-7-19(23)14-20/h3-8,13-14H,9-12,15H2,1-2H3/p+1