4-fluoranyl-2-[5-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1,2-oxazol-3-yl]benzaldehyde

Systemtic Name: 4-fluoranyl-2-[5-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1,2-oxazol-3-yl]benzaldehyde Openeye Name: 4-fluoro-2-[5-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]isoxazol-3-yl]benzaldehyde CAS Name: 4-fluoro-2-[5-[[4-(2-hydroxyethyl)-1-piperazinyl]methyl]-3-isoxazolyl]benzaldehyde IUPAC Name: 4-fluoro-2-[5-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]-1,2-oxazol-3-yl]benzaldehyde Traditional Name: 4-fluoro-2-[5-[[4-(2-hydroxyethyl)piperazino]methyl]isoxazol-3-yl]benzaldehyde Formula: C17H20FN3O3 MolecularWeight: 333.357403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)CC2=CC(=NO2)C3=C(C=CC(=C3)F)C=O

Isomeric SMILES

C1CN(CCN1CCO)CC2=CC(=NO2)C3=C(C=CC(=C3)F)C=O

InChI

InChI=1S/C17H20FN3O3/c18-14-2-1-13(12-23)16(9-14)17-10-15(24-19-17)11-21-5-3-20(4-6-21)7-8-22/h1-2,9-10,12,22H,3-8,11H2