2-(3-chlorophenyl)-3,8-dimethyl-quinoline-4-carboxylate

Systemtic Name: 2-(3-chlorophenyl)-3,8-dimethyl-quinoline-4-carboxylate Openeye Name: 2-(3-chlorophenyl)-3,8-dimethyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3,8-dimethyl-4-quinolinecarboxylate IUPAC Name: 2-(3-chlorophenyl)-3,8-dimethylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3,8-dimethyl-cinchoninate Formula: C18H13ClNO2- MolecularWeight: 310.75432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C(=C(N=C12)C3=CC(=CC=C3)Cl)C)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC2=C(C(=C(N=C12)C3=CC(=CC=C3)Cl)C)C(=O)[O-]

InChI

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