[5-[(2,6-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [5-[(2,6-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [5-[(2,6-dimethylphenoxy)methyl]isoxazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [5-[(2,6-dimethylphenoxy)methyl]-3-isoxazolyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [5-[(2,6-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [5-[(2,6-dimethylphenoxy)methyl]isoxazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C19H26N3O3+ MolecularWeight: 344.42804

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=NOC(=C2)COC3=C(C=CC=C3C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=NOC(=C2)COC3=C(C=CC=C3C)C

InChI

InChI=1S/C19H25N3O3/c1-4-21-8-10-22(11-9-21)19(23)17-12-16(25-20-17)13-24-18-14(2)6-5-7-15(18)3/h5-7,12H,4,8-11,13H2,1-3H3/p+1