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

Systemtic Name: 3-(4-azanylbutyl)-7-chloranyl-2-(4-iodophenyl)-1H-indole-4-carboxylic acid Openeye Name: 3-(4-aminobutyl)-7-chloro-2-(4-iodophenyl)-1H-indole-4-carboxylic acid CAS Name: 3-(4-aminobutyl)-7-chloro-2-(4-iodophenyl)-1H-indole-4-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-7-chloro-2-(4-iodophenyl)-1H-indole-4-carboxylic acid Traditional Name: 3-(4-aminobutyl)-7-chloro-2-(4-iodophenyl)-1H-indole-4-carboxylic acid Formula: C19H18ClIN2O2 MolecularWeight: 468.71589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C3=C(C=CC(=C3N2)Cl)C(=O)O)CCCCN)I

Isomeric SMILES

C1=CC(=CC=C1C2=C(C3=C(C=CC(=C3N2)Cl)C(=O)O)CCCCN)I

InChI

InChI=1S/C19H18ClIN2O2/c20-15-9-8-14(19(24)25)16-13(3-1-2-10-22)17(23-18(15)16)11-4-6-12(21)7-5-11/h4-9,23H,1-3,10,22H2,(H,24,25)