5-chloranyl-3-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 5-chloranyl-3-[2-oxidanylidene-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-[2-oxo-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-[2-keto-2-[4-(2-pyridyl)piperazino]ethyl]-1H-indole-2-carboxylic acid Formula: C20H19ClN4O3 MolecularWeight: 398.84286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CC3=C(NC4=C3C=C(C=C4)Cl)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CC3=C(NC4=C3C=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C20H19ClN4O3/c21-13-4-5-16-14(11-13)15(19(23-16)20(27)28)12-18(26)25-9-7-24(8-10-25)17-3-1-2-6-22-17/h1-6,11,23H,7-10,12H2,(H,27,28)