2-[3-(8-chloranylquinolin-4-yl)-5-cyano-2-methyl-indol-1-yl]ethanoic acid

Systemtic Name: 2-[3-(8-chloranylquinolin-4-yl)-5-cyano-2-methyl-indol-1-yl]ethanoic acid Openeye Name: 2-[3-(8-chloro-4-quinolyl)-5-cyano-2-methyl-indol-1-yl]acetic acid CAS Name: 2-[3-(8-chloro-4-quinolinyl)-5-cyano-2-methyl-1-indolyl]acetic acid IUPAC Name: 2-[3-(8-chloroquinolin-4-yl)-5-cyano-2-methylindol-1-yl]acetic acid Traditional Name: 2-[3-(8-chloro-4-quinolyl)-5-cyano-2-methyl-indol-1-yl]acetic acid Formula: C21H14ClN3O2 MolecularWeight: 375.80776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)C#N)C3=C4C=CC=C(C4=NC=C3)Cl

Isomeric SMILES

CC1=C(C2=C(N1CC(=O)O)C=CC(=C2)C#N)C3=C4C=CC=C(C4=NC=C3)Cl

InChI

InChI=1S/C21H14ClN3O2/c1-12-20(14-7-8-24-21-15(14)3-2-4-17(21)22)16-9-13(10-23)5-6-18(16)25(12)11-19(26)27/h2-9H,11H2,1H3,(H,26,27)