(2S)-4-azanyl-2-[(3-chloranyl-4-oxidanyl-phenyl)carbonylamino]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-4-azanyl-2-[(3-chloranyl-4-oxidanyl-phenyl)carbonylamino]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-amino-2-[(3-chloro-4-hydroxy-benzoyl)amino]-4-oxo-butanoate CAS Name: (2S)-4-amino-2-[[(3-chloro-4-hydroxyphenyl)-oxomethyl]amino]-4-oxobutanoate IUPAC Name: (2S)-4-amino-2-[(3-chloro-4-hydroxybenzoyl)amino]-4-oxobutanoate Traditional Name: (2S)-4-amino-2-[(3-chloro-4-hydroxy-benzoyl)amino]-4-keto-butyrate Formula: C11H10ClN2O5- MolecularWeight: 285.6605

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NC(CC(=O)N)C(=O)[O-])Cl)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N[C@@H](CC(=O)N)C(=O)[O-])Cl)O

InChI

InChI=1S/C11H11ClN2O5/c12-6-3-5(1-2-8(6)15)10(17)14-7(11(18)19)4-9(13)16/h1-3,7,15H,4H2,(H2,13,16)(H,14,17)(H,18,19)/p-1/t7-/m0/s1