(7-chloranyl-1,3-benzodioxol-5-yl)methyl quinoline-2-carboxylate

Systemtic Name: (7-chloranyl-1,3-benzodioxol-5-yl)methyl quinoline-2-carboxylate Openeye Name: (7-chloro-1,3-benzodioxol-5-yl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (7-chloro-1,3-benzodioxol-5-yl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester Formula: C18H12ClNO4 MolecularWeight: 341.74518

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)COC(=O)C3=NC4=CC=CC=C4C=C3)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)COC(=O)C3=NC4=CC=CC=C4C=C3)Cl

InChI

InChI=1S/C18H12ClNO4/c19-13-7-11(8-16-17(13)24-10-23-16)9-22-18(21)15-6-5-12-3-1-2-4-14(12)20-15/h1-8H,9-10H2