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

Systemtic Name: 2-[3-(4-azanylbutyl)-2-(2-methoxypyridin-3-yl)-1H-indol-5-yl]ethanoic acid Openeye Name: 2-[3-(4-aminobutyl)-2-(2-methoxy-3-pyridyl)-1H-indol-5-yl]acetic acid CAS Name: 2-[3-(4-aminobutyl)-2-(2-methoxy-3-pyridinyl)-1H-indol-5-yl]acetic acid IUPAC Name: 2-[3-(4-aminobutyl)-2-(2-methoxypyridin-3-yl)-1H-indol-5-yl]acetic acid Traditional Name: 2-[3-(4-aminobutyl)-2-(2-methoxy-3-pyridyl)-1H-indol-5-yl]acetic acid Formula: C20H23N3O3 MolecularWeight: 353.41492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)C2=C(C3=C(N2)C=CC(=C3)CC(=O)O)CCCCN

Isomeric SMILES

COC1=C(C=CC=N1)C2=C(C3=C(N2)C=CC(=C3)CC(=O)O)CCCCN

InChI

InChI=1S/C20H23N3O3/c1-26-20-15(6-4-10-22-20)19-14(5-2-3-9-21)16-11-13(12-18(24)25)7-8-17(16)23-19/h4,6-8,10-11,23H,2-3,5,9,12,21H2,1H3,(H,24,25)