3-(4-azanylbutyl)-2-quinolin-8-yl-1H-indole-5-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-2-quinolin-8-yl-1H-indole-5-carboxylic acid Openeye Name: 3-(4-aminobutyl)-2-(8-quinolyl)-1H-indole-5-carboxylic acid CAS Name: 3-(4-aminobutyl)-2-(8-quinolinyl)-1H-indole-5-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-2-quinolin-8-yl-1H-indole-5-carboxylic acid Traditional Name: 3-(4-aminobutyl)-2-(8-quinolyl)-1H-indole-5-carboxylic acid Formula: C22H21N3O2 MolecularWeight: 359.42104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C3=C(C4=C(N3)C=CC(=C4)C(=O)O)CCCCN)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)C3=C(C4=C(N3)C=CC(=C4)C(=O)O)CCCCN)N=CC=C2

InChI

InChI=1S/C22H21N3O2/c23-11-2-1-7-16-18-13-15(22(26)27)9-10-19(18)25-21(16)17-8-3-5-14-6-4-12-24-20(14)17/h3-6,8-10,12-13,25H,1-2,7,11,23H2,(H,26,27)