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

Systemtic Name: (2-bromophenyl)methyl-[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (2-bromophenyl)methyl-[2-[(3-tert-butylisoxazol-5-yl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (2-bromophenyl)methyl-[2-[(3-tert-butyl-5-isoxazolyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (2-bromophenyl)methyl-[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: (2-bromobenzyl)-[2-[(3-tert-butylisoxazol-5-yl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C17H23BrN3O2+ MolecularWeight: 381.28742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1)NC(=O)C[NH+](C)CC2=CC=CC=C2Br

Isomeric SMILES

CC(C)(C)C1=NOC(=C1)NC(=O)C[NH+](C)CC2=CC=CC=C2Br

InChI

InChI=1S/C17H22BrN3O2/c1-17(2,3)14-9-16(23-20-14)19-15(22)11-21(4)10-12-7-5-6-8-13(12)18/h5-9H,10-11H2,1-4H3,(H,19,22)/p+1