[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 2-[(2-bromophenyl)carbonylamino]ethanoate

Systemtic Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] 2-[(2-bromophenyl)carbonylamino]ethanoate Openeye Name: [2-[[(1S)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] 2-[(2-bromobenzoyl)amino]acetate CAS Name: 2-[[(2-bromophenyl)-oxomethyl]amino]acetic acid [2-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl] 2-[(2-bromobenzoyl)amino]acetate Traditional Name: 2-[(2-bromobenzoyl)amino]acetic acid [2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C16H20BrN3O5 MolecularWeight: 414.2511

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)COC(=O)CNC(=O)C1=CC=CC=C1Br

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)COC(=O)CNC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C16H20BrN3O5/c1-3-10(2)19-16(24)20-13(21)9-25-14(22)8-18-15(23)11-6-4-5-7-12(11)17/h4-7,10H,3,8-9H2,1-2H3,(H,18,23)(H2,19,20,21,24)/t10-/m0/s1