(2S)-4-azanyl-2-[(5-bromanylpyridin-3-yl)carbonylamino]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-azanyl-2-[(5-bromanylpyridin-3-yl)carbonylamino]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-amino-2-[(5-bromopyridine-3-carbonyl)amino]-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-4-oxobutanoate IUPAC Name: (2S)-4-amino-2-[(5-bromopyridine-3-carbonyl)amino]-4-oxobutanoate Traditional Name: (2S)-4-amino-2-[(5-bromonicotinoyl)amino]-4-keto-butyrate Formula: C10H9BrN3O4- MolecularWeight: 315.10016

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC=C1Br)C(=O)NC(CC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=C(C=NC=C1Br)C(=O)N[C@@H](CC(=O)N)C(=O)[O-]

InChI

InChI=1S/C10H10BrN3O4/c11-6-1-5(3-13-4-6)9(16)14-7(10(17)18)2-8(12)15/h1,3-4,7H,2H2,(H2,12,15)(H,14,16)(H,17,18)/p-1/t7-/m0/s1