2-(1,3-benzodioxol-5-yl)-8-chloranyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-8-chloranyl-quinoline-4-carboxylic acid Openeye Name: 2-(1,3-benzodioxol-5-yl)-8-chloro-quinoline-4-carboxylic acid CAS Name: 2-(1,3-benzodioxol-5-yl)-8-chloro-4-quinolinecarboxylic acid IUPAC Name: 2-(1,3-benzodioxol-5-yl)-8-chloroquinoline-4-carboxylic acid Traditional Name: 2-(1,3-benzodioxol-5-yl)-8-chloro-cinchoninic acid Formula: C17H10ClNO4 MolecularWeight: 327.7186

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NC4=C(C=CC=C4Cl)C(=C3)C(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NC4=C(C=CC=C4Cl)C(=C3)C(=O)O

InChI

InChI=1S/C17H10ClNO4/c18-12-3-1-2-10-11(17(20)21)7-13(19-16(10)12)9-4-5-14-15(6-9)23-8-22-14/h1-7H,8H2,(H,20,21)