2-(5-bromanyl-1H-indol-3-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)ethanoic acid

Systemtic Name: 2-(5-bromanyl-1H-indol-3-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)ethanoic acid Openeye Name: 2-(5-bromo-1H-indol-3-yl)-2-[4-(2-pyridyl)piperazin-1-yl]acetic acid CAS Name: 2-(5-bromo-1H-indol-3-yl)-2-[4-(2-pyridinyl)-1-piperazinyl]acetic acid IUPAC Name: 2-(5-bromo-1H-indol-3-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetic acid Traditional Name: 2-(5-bromo-1H-indol-3-yl)-2-[4-(2-pyridyl)piperazino]acetic acid Formula: C19H19BrN4O2 MolecularWeight: 415.28376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(C3=CNC4=C3C=C(C=C4)Br)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(C3=CNC4=C3C=C(C=C4)Br)C(=O)O

InChI

InChI=1S/C19H19BrN4O2/c20-13-4-5-16-14(11-13)15(12-22-16)18(19(25)26)24-9-7-23(8-10-24)17-3-1-2-6-21-17/h1-6,11-12,18,22H,7-10H2,(H,25,26)