3-carboxy-4-[[(2R)-2-oxidanylpropyl]amino]quinoline-6-carboxylate

Systemtic Name: 3-carboxy-4-[[(2R)-2-oxidanylpropyl]amino]quinoline-6-carboxylate Openeye Name: 3-carboxy-4-[[(2R)-2-hydroxypropyl]amino]quinoline-6-carboxylate CAS Name: 3-carboxy-4-[[(2R)-2-hydroxypropyl]amino]-6-quinolinecarboxylate IUPAC Name: 3-carboxy-4-[[(2R)-2-hydroxypropyl]amino]quinoline-6-carboxylate Traditional Name: 3-carboxy-4-[[(2R)-2-hydroxypropyl]amino]quinoline-6-carboxylate Formula: C14H13N2O5- MolecularWeight: 289.26342

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C2C=C(C=CC2=NC=C1C(=O)O)C(=O)[O-])O

Isomeric SMILES

C[C@H](CNC1=C2C=C(C=CC2=NC=C1C(=O)O)C(=O)[O-])O

InChI

InChI=1S/C14H14N2O5/c1-7(17)5-16-12-9-4-8(13(18)19)2-3-11(9)15-6-10(12)14(20)21/h2-4,6-7,17H,5H2,1H3,(H,15,16)(H,18,19)(H,20,21)/p-1/t7-/m1/s1