2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(3,5-dimethylisoxazol-4-yl)ethanone CAS Name: 2-(3,5-dimethyl-4-isoxazolyl)-1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)ethanone Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(3,5-dimethylisoxazol-4-yl)ethanone Formula: C24H28N3O2+ MolecularWeight: 390.49802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O2/c1-18-22(19(2)29-25-18)17-23(28)26-13-15-27(16-14-26)24(20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,24H,13-17H2,1-2H3/p+1