8-chloranyl-2-(2,4-dimethylphenyl)quinoline-4-carboxylate

Systemtic Name: 8-chloranyl-2-(2,4-dimethylphenyl)quinoline-4-carboxylate Openeye Name: 8-chloro-2-(2,4-dimethylphenyl)quinoline-4-carboxylate CAS Name: 8-chloro-2-(2,4-dimethylphenyl)-4-quinolinecarboxylate IUPAC Name: 8-chloro-2-(2,4-dimethylphenyl)quinoline-4-carboxylate Traditional Name: 8-chloro-2-(2,4-dimethylphenyl)cinchoninate Formula: C18H13ClNO2- MolecularWeight: 310.75432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=C(C=CC=C3Cl)C(=C2)C(=O)[O-])C

InChI

InChI=1S/C18H14ClNO2/c1-10-6-7-12(11(2)8-10)16-9-14(18(21)22)13-4-3-5-15(19)17(13)20-16/h3-9H,1-2H3,(H,21,22)/p-1