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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=CC=NC2=C1)C3=C(C4=C(N3)C=CC(=C4)C(=O)O)CCCCN

Isomeric SMILES

C1=CC(=C2C=CC=NC2=C1)C3=C(C4=C(N3)C=CC(=C4)C(=O)O)CCCCN

InChI

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