4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoic acid

Systemtic Name: 4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoic acid Openeye Name: 4-[5-methyl-2-(2-quinolyl)-1H-indol-3-yl]butanoic acid CAS Name: 4-[5-methyl-2-(2-quinolinyl)-1H-indol-3-yl]butanoic acid IUPAC Name: 4-(5-methyl-2-quinolin-2-yl-1H-indol-3-yl)butanoic acid Traditional Name: 4-[5-methyl-2-(2-quinolyl)-1H-indol-3-yl]butyric acid Formula: C22H20N2O2 MolecularWeight: 344.4064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H20N2O2/c1-14-9-11-19-17(13-14)16(6-4-8-21(25)26)22(24-19)20-12-10-15-5-2-3-7-18(15)23-20/h2-3,5,7,9-13,24H,4,6,8H2,1H3,(H,25,26)