(2S)-2-[(2R)-4-[2-(2-bromophenyl)carbonylhydrazinyl]-4-oxidanylidene-butan-2-yl]hexanoate

Systemtic Name: (2S)-2-[(2R)-4-[2-(2-bromophenyl)carbonylhydrazinyl]-4-oxidanylidene-butan-2-yl]hexanoate Openeye Name: (2S)-2-[(1R)-3-[2-(2-bromobenzoyl)hydrazino]-1-methyl-3-oxo-propyl]hexanoate CAS Name: (2S)-2-[(2R)-4-[[(2-bromophenyl)-oxomethyl]hydrazo]-4-oxobutan-2-yl]hexanoate IUPAC Name: (2S)-2-[(2R)-4-[2-(2-bromobenzoyl)hydrazinyl]-4-oxobutan-2-yl]hexanoate Traditional Name: (2S)-2-[(1R)-3-[N'-(2-bromobenzoyl)hydrazino]-3-keto-1-methyl-propyl]hexanoate Formula: C17H22BrN2O4- MolecularWeight: 398.27158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C)CC(=O)NNC(=O)C1=CC=CC=C1Br)C(=O)[O-]

Isomeric SMILES

CCCC[C@@H]([C@H](C)CC(=O)NNC(=O)C1=CC=CC=C1Br)C(=O)[O-]

InChI

InChI=1S/C17H23BrN2O4/c1-3-4-7-12(17(23)24)11(2)10-15(21)19-20-16(22)13-8-5-6-9-14(13)18/h5-6,8-9,11-12H,3-4,7,10H2,1-2H3,(H,19,21)(H,20,22)(H,23,24)/p-1/t11-,12+/m1/s1