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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)C3=C(C4=C(N3)C=CC(=C4)C(=O)O)CCCCN

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)C3=C(C4=C(N3)C=CC(=C4)C(=O)O)CCCCN

InChI

InChI=1S/C22H21N3O2/c23-10-4-3-6-17-18-12-15(22(26)27)8-9-20(18)25-21(17)16-11-14-5-1-2-7-19(14)24-13-16/h1-2,5,7-9,11-13,25H,3-4,6,10,23H2,(H,26,27)