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

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3,5-dimethylisoxazol-4-yl)-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3,5-dimethyl-4-isoxazolyl)-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3,5-dimethylisoxazol-4-yl)-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3=C(ON=C3C)C

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3=C(ON=C3C)C

InChI

InChI=1S/C18H23N3O2/c1-13-6-4-5-7-16(13)12-20-8-10-21(11-9-20)18(22)17-14(2)19-23-15(17)3/h4-7H,8-12H2,1-3H3/p+1