6-chloranyl-2-[[(2S)-1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]quinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-2-[[(2S)-1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl]amino]quinoline-3-carboxylic acid Openeye Name: 2-[[(1S)-1-benzyl-2-hydroxy-2-oxo-ethyl]amino]-6-chloro-quinoline-3-carboxylic acid CAS Name: 6-chloro-2-[[(2S)-1-hydroxy-1-oxo-3-phenylpropan-2-yl]amino]-3-quinolinecarboxylic acid IUPAC Name: 6-chloro-2-[[(2S)-1-hydroxy-1-oxo-3-phenylpropan-2-yl]amino]quinoline-3-carboxylic acid Traditional Name: 2-[[(1S)-1-benzyl-2-hydroxy-2-keto-ethyl]amino]-6-chloro-quinoline-3-carboxylic acid Formula: C19H15ClN2O4 MolecularWeight: 370.7864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC2=C(C=C3C=C(C=CC3=N2)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)NC2=C(C=C3C=C(C=CC3=N2)Cl)C(=O)O

InChI

InChI=1S/C19H15ClN2O4/c20-13-6-7-15-12(9-13)10-14(18(23)24)17(21-15)22-16(19(25)26)8-11-4-2-1-3-5-11/h1-7,9-10,16H,8H2,(H,21,22)(H,23,24)(H,25,26)/t16-/m0/s1