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

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-8-chloranyl-quinoline-4-carboxylate Openeye Name: 2-(1,3-benzodioxol-5-yl)-8-chloro-quinoline-4-carboxylate CAS Name: 2-(1,3-benzodioxol-5-yl)-8-chloro-4-quinolinecarboxylate IUPAC Name: 2-(1,3-benzodioxol-5-yl)-8-chloroquinoline-4-carboxylate Traditional Name: 2-(1,3-benzodioxol-5-yl)-8-chloro-cinchoninate Formula: C17H9ClNO4- MolecularWeight: 326.71066

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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)/p-1