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

Systemtic Name: 2-(5-phenylmethoxy-1H-indol-3-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)ethanoic acid Openeye Name: 2-(5-benzyloxy-1H-indol-3-yl)-2-[4-(2-pyridyl)piperazin-1-yl]acetic acid CAS Name: 2-(5-phenylmethoxy-1H-indol-3-yl)-2-[4-(2-pyridinyl)-1-piperazinyl]acetic acid IUPAC Name: 2-(5-phenylmethoxy-1H-indol-3-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetic acid Traditional Name: 2-(5-benzoxy-1H-indol-3-yl)-2-[4-(2-pyridyl)piperazino]acetic acid Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(C3=CNC4=C3C=C(C=C4)OCC5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(C3=CNC4=C3C=C(C=C4)OCC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C26H26N4O3/c31-26(32)25(30-14-12-29(13-15-30)24-8-4-5-11-27-24)22-17-28-23-10-9-20(16-21(22)23)33-18-19-6-2-1-3-7-19/h1-11,16-17,25,28H,12-15,18H2,(H,31,32)