2-[3-(4-azanylbutyl)-2-(3-chloranylpyridin-4-yl)-1H-indol-5-yl]ethanoic acid

Systemtic Name: 2-[3-(4-azanylbutyl)-2-(3-chloranylpyridin-4-yl)-1H-indol-5-yl]ethanoic acid Openeye Name: 2-[3-(4-aminobutyl)-2-(3-chloro-4-pyridyl)-1H-indol-5-yl]acetic acid CAS Name: 2-[3-(4-aminobutyl)-2-(3-chloro-4-pyridinyl)-1H-indol-5-yl]acetic acid IUPAC Name: 2-[3-(4-aminobutyl)-2-(3-chloropyridin-4-yl)-1H-indol-5-yl]acetic acid Traditional Name: 2-[3-(4-aminobutyl)-2-(3-chloro-4-pyridyl)-1H-indol-5-yl]acetic acid Formula: C19H20ClN3O2 MolecularWeight: 357.834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CC(=O)O)C(=C(N2)C3=C(C=NC=C3)Cl)CCCCN

Isomeric SMILES

C1=CC2=C(C=C1CC(=O)O)C(=C(N2)C3=C(C=NC=C3)Cl)CCCCN

InChI

InChI=1S/C19H20ClN3O2/c20-16-11-22-8-6-14(16)19-13(3-1-2-7-21)15-9-12(10-18(24)25)4-5-17(15)23-19/h4-6,8-9,11,23H,1-3,7,10,21H2,(H,24,25)