3-[2-(2-methoxy-4-pyridin-2-yl-piperazin-1-yl)ethyl]-1H-indole hydrate

Systemtic Name: 3-[2-(2-methoxy-4-pyridin-2-yl-piperazin-1-yl)ethyl]-1H-indole hydrate Openeye Name: 3-[2-[2-methoxy-4-(2-pyridyl)piperazin-1-yl]ethyl]-1H-indole hydrate CAS Name: 3-[2-[2-methoxy-4-(2-pyridinyl)-1-piperazinyl]ethyl]-1H-indole hydrate IUPAC Name: 3-[2-(2-methoxy-4-pyridin-2-ylpiperazin-1-yl)ethyl]-1H-indole hydrate Traditional Name: 3-[2-[2-methoxy-4-(2-pyridyl)piperazino]ethyl]-1H-indole hydrate Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCN1CCC2=CNC3=CC=CC=C32)C4=CC=CC=N4.O

Isomeric SMILES

COC1CN(CCN1CCC2=CNC3=CC=CC=C32)C4=CC=CC=N4.O

InChI

InChI=1S/C20H24N4O.H2O/c1-25-20-15-24(19-8-4-5-10-21-19)13-12-23(20)11-9-16-14-22-18-7-3-2-6-17(16)18;/h2-8,10,14,20,22H,9,11-13,15H2,1H3;1H2