2-(5-methoxy-1H-indol-2-yl)-1,3-dipyridin-3-yl-propan-2-ol hydrate

Systemtic Name: 2-(5-methoxy-1H-indol-2-yl)-1,3-dipyridin-3-yl-propan-2-ol hydrate Openeye Name: 2-(5-methoxy-1H-indol-2-yl)-1,3-bis(3-pyridyl)propan-2-ol hydrate CAS Name: 2-(5-methoxy-1H-indol-2-yl)-1,3-bis(3-pyridinyl)-2-propanol hydrate IUPAC Name: 2-(5-methoxy-1H-indol-2-yl)-1,3-dipyridin-3-ylpropan-2-ol hydrate Traditional Name: 2-(5-methoxy-1H-indol-2-yl)-1,3-bis(3-pyridyl)propan-2-ol hydrate Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=C2)C(CC3=CN=CC=C3)(CC4=CN=CC=C4)O.O

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=C2)C(CC3=CN=CC=C3)(CC4=CN=CC=C4)O.O

InChI

InChI=1S/C22H21N3O2.H2O/c1-27-19-6-7-20-18(10-19)11-21(25-20)22(26,12-16-4-2-8-23-14-16)13-17-5-3-9-24-15-17;/h2-11,14-15,25-26H,12-13H2,1H3;1H2