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

Systemtic Name: 3-(4-azanylbutyl)-2-(3-chloranylpyridin-4-yl)-1H-indole-5-carboxylic acid Openeye Name: 3-(4-aminobutyl)-2-(3-chloro-4-pyridyl)-1H-indole-5-carboxylic acid CAS Name: 3-(4-aminobutyl)-2-(3-chloro-4-pyridinyl)-1H-indole-5-carboxylic acid IUPAC Name: 3-(4-aminobutyl)-2-(3-chloropyridin-4-yl)-1H-indole-5-carboxylic acid Traditional Name: 3-(4-aminobutyl)-2-(3-chloro-4-pyridyl)-1H-indole-5-carboxylic acid Formula: C18H18ClN3O2 MolecularWeight: 343.80742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)C(=C(N2)C3=C(C=NC=C3)Cl)CCCCN

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)C(=C(N2)C3=C(C=NC=C3)Cl)CCCCN

InChI

InChI=1S/C18H18ClN3O2/c19-15-10-21-8-6-13(15)17-12(3-1-2-7-20)14-9-11(18(23)24)4-5-16(14)22-17/h4-6,8-10,22H,1-3,7,20H2,(H,23,24)