3-(4-azanylbutyl)-7-chloranyl-2-(5-methylpyridin-2-yl)-1H-indole-4-carboxylic acid

Systemtic Name: 3-(4-azanylbutyl)-7-chloranyl-2-(5-methylpyridin-2-yl)-1H-indole-4-carboxylic acid Openeye Name: 3-(4-aminobutyl)-7-chloro-2-(5-methyl-2-pyridyl)-1H-indole-4-carboxylic acid CAS Name: 3-(4-aminobutyl)-7-chloro-2-(5-methyl-2-pyridinyl)-1H-indole-4-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-7-chloro-2-(5-methylpyridin-2-yl)-1H-indole-4-carboxylic acid Traditional Name: 3-(4-aminobutyl)-7-chloro-2-(5-methyl-2-pyridyl)-1H-indole-4-carboxylic acid Formula: C19H20ClN3O2 MolecularWeight: 357.834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C2=C(C3=C(C=CC(=C3N2)Cl)C(=O)O)CCCCN

Isomeric SMILES

CC1=CN=C(C=C1)C2=C(C3=C(C=CC(=C3N2)Cl)C(=O)O)CCCCN

InChI

InChI=1S/C19H20ClN3O2/c1-11-5-8-15(22-10-11)17-12(4-2-3-9-21)16-13(19(24)25)6-7-14(20)18(16)23-17/h5-8,10,23H,2-4,9,21H2,1H3,(H,24,25)