6-[5,6-bis(chloranyl)-3-methyl-2-pyridin-3-yl-indol-1-yl]hexanoic acid

Systemtic Name: 6-[5,6-bis(chloranyl)-3-methyl-2-pyridin-3-yl-indol-1-yl]hexanoic acid Openeye Name: 6-[5,6-dichloro-3-methyl-2-(3-pyridyl)indol-1-yl]hexanoic acid CAS Name: 6-[5,6-dichloro-3-methyl-2-(3-pyridinyl)-1-indolyl]hexanoic acid IUPAC Name: 6-(5,6-dichloro-3-methyl-2-pyridin-3-ylindol-1-yl)hexanoic acid Traditional Name: 6-[5,6-dichloro-3-methyl-2-(3-pyridyl)indol-1-yl]hexanoic acid Formula: C20H20Cl2N2O2 MolecularWeight: 391.291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC(=C(C=C12)Cl)Cl)CCCCCC(=O)O)C3=CN=CC=C3

Isomeric SMILES

CC1=C(N(C2=CC(=C(C=C12)Cl)Cl)CCCCCC(=O)O)C3=CN=CC=C3

InChI

InChI=1S/C20H20Cl2N2O2/c1-13-15-10-16(21)17(22)11-18(15)24(9-4-2-3-7-19(25)26)20(13)14-6-5-8-23-12-14/h5-6,8,10-12H,2-4,7,9H2,1H3,(H,25,26)