(2S)-5-azanyl-2-[(4-chloranyl-2-oxidanyl-phenyl)carbonylamino]-5-oxidanylidene-pentanoate

Systemtic Name: (2S)-5-azanyl-2-[(4-chloranyl-2-oxidanyl-phenyl)carbonylamino]-5-oxidanylidene-pentanoate Openeye Name: (2S)-5-amino-2-[(4-chloro-2-hydroxy-benzoyl)amino]-5-oxo-pentanoate CAS Name: (2S)-5-amino-2-[[(4-chloro-2-hydroxyphenyl)-oxomethyl]amino]-5-oxopentanoate IUPAC Name: (2S)-5-amino-2-[(4-chloro-2-hydroxybenzoyl)amino]-5-oxopentanoate Traditional Name: (2S)-5-amino-2-[(4-chloro-2-hydroxy-benzoyl)amino]-5-keto-valerate Formula: C12H12ClN2O5- MolecularWeight: 299.68708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClN2O5/c13-6-1-2-7(9(16)5-6)11(18)15-8(12(19)20)3-4-10(14)17/h1-2,5,8,16H,3-4H2,(H2,14,17)(H,15,18)(H,19,20)/p-1/t8-/m0/s1