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

Systemtic Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-ethyl-5-methyl-isoxazol-4-yl)-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3-ethyl-5-methyl-4-isoxazolyl)-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3-ethyl-5-methyl-isoxazol-4-yl)-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C19H26N3O2+ MolecularWeight: 328.42864

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3C)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3C)C

InChI

InChI=1S/C19H25N3O2/c1-4-17-18(15(3)24-20-17)19(23)22-11-9-21(10-12-22)13-16-8-6-5-7-14(16)2/h5-8H,4,9-13H2,1-3H3/p+1