3-(4-azanylbutyl)-7-chloranyl-2-quinolin-3-yl-1H-indole-4-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-7-chloranyl-2-quinolin-3-yl-1H-indole-4-carboxylic acid Openeye Name: 3-(4-aminobutyl)-7-chloro-2-(3-quinolyl)-1H-indole-4-carboxylic acid CAS Name: 3-(4-aminobutyl)-7-chloro-2-(3-quinolinyl)-1H-indole-4-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-7-chloro-2-quinolin-3-yl-1H-indole-4-carboxylic acid Traditional Name: 3-(4-aminobutyl)-7-chloro-2-(3-quinolyl)-1H-indole-4-carboxylic acid Formula: C22H20ClN3O2 MolecularWeight: 393.8661

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)C3=C(C4=C(C=CC(=C4N3)Cl)C(=O)O)CCCCN

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)C3=C(C4=C(C=CC(=C4N3)Cl)C(=O)O)CCCCN

InChI

InChI=1S/C22H20ClN3O2/c23-17-9-8-16(22(27)28)19-15(6-3-4-10-24)20(26-21(17)19)14-11-13-5-1-2-7-18(13)25-12-14/h1-2,5,7-9,11-12,26H,3-4,6,10,24H2,(H,27,28)