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

Systemtic Name: 1-[4-methoxy-3-[[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-4-ium-1-yl]methyl]phenyl]ethanone Openeye Name: 1-[4-methoxy-3-[[4-[(5-methylisoxazol-3-yl)methyl]piperazin-4-ium-1-yl]methyl]phenyl]ethanone CAS Name: 1-[4-methoxy-3-[[4-[(5-methyl-3-isoxazolyl)methyl]-1-piperazin-4-iumyl]methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-[[4-[(5-methyl-1,2-oxazol-3-yl)methyl]piperazin-4-ium-1-yl]methyl]phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[[4-[(5-methylisoxazol-3-yl)methyl]piperazin-4-ium-1-yl]methyl]phenyl]ethanone Formula: C19H26N3O3+ MolecularWeight: 344.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C[NH+]2CCN(CC2)CC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CC1=CC(=NO1)C[NH+]2CCN(CC2)CC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C19H25N3O3/c1-14-10-18(20-25-14)13-22-8-6-21(7-9-22)12-17-11-16(15(2)23)4-5-19(17)24-3/h4-5,10-11H,6-9,12-13H2,1-3H3/p+1