[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] (2S)-2-[(4-bromophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] (2S)-2-[(4-bromobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-bromophenyl)-oxomethyl]amino]-3-methylbutanoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] (2S)-2-[(4-bromobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-bromobenzoyl)amino]-3-methyl-butyric acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H23BrN2O4 MolecularWeight: 399.27952

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C(C(C)C)NC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)[C@H](C(C)C)NC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C17H23BrN2O4/c1-5-19-15(21)11(4)24-17(23)14(10(2)3)20-16(22)12-6-8-13(18)9-7-12/h6-11,14H,5H2,1-4H3,(H,19,21)(H,20,22)/t11-,14-/m0/s1