4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)quinoline-3,6-dicarboxylic acid hydrochloride

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)quinoline-3,6-dicarboxylic acid hydrochloride Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)quinoline-3,6-dicarboxylic acid hydrochloride CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)quinoline-3,6-dicarboxylic acid hydrochloride IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)quinoline-3,6-dicarboxylic acid hydrochloride Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)quinoline-3,6-dicarboxylic acid hydrochloride Formula: C19H15ClN2O6 MolecularWeight: 402.7852

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=C4C=C(C=CC4=NC=C3C(=O)O)C(=O)O.Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=C4C=C(C=CC4=NC=C3C(=O)O)C(=O)O.Cl

InChI

InChI=1S/C19H14N2O6.ClH/c22-18(23)10-1-3-14-12(7-10)17(13(9-20-14)19(24)25)21-11-2-4-15-16(8-11)27-6-5-26-15;/h1-4,7-9H,5-6H2,(H,20,21)(H,22,23)(H,24,25);1H