8-ethyl-2-(1H-indol-3-ylmethyl)-3-oxidanyl-quinoline-4-carboxylic acid

Systemtic Name: 8-ethyl-2-(1H-indol-3-ylmethyl)-3-oxidanyl-quinoline-4-carboxylic acid Openeye Name: 8-ethyl-3-hydroxy-2-(1H-indol-3-ylmethyl)quinoline-4-carboxylic acid CAS Name: 8-ethyl-3-hydroxy-2-(1H-indol-3-ylmethyl)-4-quinolinecarboxylic acid IUPAC Name: 8-ethyl-3-hydroxy-2-(1H-indol-3-ylmethyl)quinoline-4-carboxylic acid Traditional Name: 8-ethyl-3-hydroxy-2-(1H-indol-3-ylmethyl)cinchoninic acid Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C(C(=C(N=C21)CC3=CNC4=CC=CC=C43)O)C(=O)O

Isomeric SMILES

CCC1=CC=CC2=C(C(=C(N=C21)CC3=CNC4=CC=CC=C43)O)C(=O)O

InChI

InChI=1S/C21H18N2O3/c1-2-12-6-5-8-15-18(21(25)26)20(24)17(23-19(12)15)10-13-11-22-16-9-4-3-7-14(13)16/h3-9,11,22,24H,2,10H2,1H3,(H,25,26)