7-chloranyl-3-ethyl-2-phenyl-quinoline-4-carboxylic acid

Systemtic Name: 7-chloranyl-3-ethyl-2-phenyl-quinoline-4-carboxylic acid Openeye Name: 7-chloro-3-ethyl-2-phenyl-quinoline-4-carboxylic acid CAS Name: 7-chloro-3-ethyl-2-phenyl-4-quinolinecarboxylic acid IUPAC Name: 7-chloro-3-ethyl-2-phenylquinoline-4-carboxylic acid Traditional Name: 7-chloro-3-ethyl-2-phenyl-cinchoninic acid Formula: C18H14ClNO2 MolecularWeight: 311.76226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(N=C2C=C(C=CC2=C1C(=O)O)Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H14ClNO2/c1-2-13-16(18(21)22)14-9-8-12(19)10-15(14)20-17(13)11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H,21,22)