2-(3-chloranyl-4-methoxy-phenyl)-6-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(3-chloranyl-4-methoxy-phenyl)-6-methyl-quinoline-4-carboxylic acid Openeye Name: 2-(3-chloro-4-methoxy-phenyl)-6-methyl-quinoline-4-carboxylic acid CAS Name: 2-(3-chloro-4-methoxyphenyl)-6-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-(3-chloro-4-methoxyphenyl)-6-methylquinoline-4-carboxylic acid Traditional Name: 2-(3-chloro-4-methoxy-phenyl)-6-methyl-cinchoninic acid Formula: C18H14ClNO3 MolecularWeight: 327.76166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC(=C(C=C3)OC)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)O)C3=CC(=C(C=C3)OC)Cl

InChI

InChI=1S/C18H14ClNO3/c1-10-3-5-15-12(7-10)13(18(21)22)9-16(20-15)11-4-6-17(23-2)14(19)8-11/h3-9H,1-2H3,(H,21,22)