(4-bromophenyl)methyl-[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-bromophenyl)methyl-[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-methyl-[2-[[(1S)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl]ammonium CAS Name: (4-bromophenyl)methyl-[2-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl]-methylazanium Traditional Name: (4-bromobenzyl)-[2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl]-methyl-ammonium Formula: C15H23BrN3O2+ MolecularWeight: 357.26602

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)C[NH+](C)CC1=CC=C(C=C1)Br

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)C[NH+](C)CC1=CC=C(C=C1)Br

InChI

InChI=1S/C15H22BrN3O2/c1-4-11(2)17-15(21)18-14(20)10-19(3)9-12-5-7-13(16)8-6-12/h5-8,11H,4,9-10H2,1-3H3,(H2,17,18,20,21)/p+1/t11-/m0/s1