[5-(4-bromophenyl)-1,2-oxazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [5-(4-bromophenyl)-1,2-oxazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [5-(4-bromophenyl)isoxazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [5-(4-bromophenyl)-3-isoxazolyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [5-(4-bromophenyl)-1,2-oxazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [5-(4-bromophenyl)isoxazol-3-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C15H17BrN3O2+ MolecularWeight: 351.21838

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=NOC(=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=NOC(=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C15H16BrN3O2/c1-18-6-8-19(9-7-18)15(20)13-10-14(21-17-13)11-2-4-12(16)5-3-11/h2-5,10H,6-9H2,1H3/p+1