(2S)-4-azanyl-2-[[4,5-bis(chloranyl)-1H-pyrrol-2-yl]carbonylamino]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-azanyl-2-[[4,5-bis(chloranyl)-1H-pyrrol-2-yl]carbonylamino]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-amino-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(4,5-dichloro-1H-pyrrol-2-yl)-oxomethyl]amino]-4-oxobutanoate IUPAC Name: (2S)-4-amino-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-4-oxobutanoate Traditional Name: (2S)-4-amino-2-[(4,5-dichloro-1H-pyrrole-2-carbonyl)amino]-4-keto-butyrate Formula: C9H8Cl2N3O4- MolecularWeight: 293.08352

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC(=C1Cl)Cl)C(=O)NC(CC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=C(NC(=C1Cl)Cl)C(=O)N[C@@H](CC(=O)N)C(=O)[O-]

InChI

InChI=1S/C9H9Cl2N3O4/c10-3-1-4(13-7(3)11)8(16)14-5(9(17)18)2-6(12)15/h1,5,13H,2H2,(H2,12,15)(H,14,16)(H,17,18)/p-1/t5-/m0/s1