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

Systemtic Name: 3-(4-azanylbutyl)-2-(2-iodanylphenyl)-1H-indole-5-carboxylic acid Openeye Name: 3-(4-aminobutyl)-2-(2-iodophenyl)-1H-indole-5-carboxylic acid CAS Name: 3-(4-aminobutyl)-2-(2-iodophenyl)-1H-indole-5-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-2-(2-iodophenyl)-1H-indole-5-carboxylic acid Traditional Name: 3-(4-aminobutyl)-2-(2-iodophenyl)-1H-indole-5-carboxylic acid Formula: C19H19IN2O2 MolecularWeight: 434.27083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CCCCN)I

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C3=C(N2)C=CC(=C3)C(=O)O)CCCCN)I

InChI

InChI=1S/C19H19IN2O2/c20-16-7-2-1-6-14(16)18-13(5-3-4-10-21)15-11-12(19(23)24)8-9-17(15)22-18/h1-2,6-9,11,22H,3-5,10,21H2,(H,23,24)