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

Systemtic Name: 1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylphenoxy)ethanone Openeye Name: 1-[4-[(5-methylisoxazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylphenoxy)ethanone CAS Name: 1-[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazin-4-iumyl]-2-(4-phenylphenoxy)ethanone IUPAC Name: 1-[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylphenoxy)ethanone Traditional Name: 1-[4-[(5-methylisoxazol-3-yl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylphenoxy)ethanone Formula: C23H26N3O3+ MolecularWeight: 392.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C[NH+]2CCN(CC2)C(=O)COC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NO1)C[NH+]2CCN(CC2)C(=O)COC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O3/c1-18-15-21(24-29-18)16-25-11-13-26(14-12-25)23(27)17-28-22-9-7-20(8-10-22)19-5-3-2-4-6-19/h2-10,15H,11-14,16-17H2,1H3/p+1