(4-bromophenyl)methyl-methyl-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-bromophenyl)methyl-methyl-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]azanium Traditional Name: (4-bromobenzyl)-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-methyl-ammonium Formula: C14H17BrN3O2+ MolecularWeight: 339.20768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H16BrN3O2/c1-10-7-13(17-20-10)16-14(19)9-18(2)8-11-3-5-12(15)6-4-11/h3-7H,8-9H2,1-2H3,(H,16,17,19)/p+1