2-[3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanyl-propoxy]xanthen-9-one

Systemtic Name: 2-[3-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxidanyl-propoxy]xanthen-9-one Openeye Name: 2-[2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propoxy]xanthen-9-one CAS Name: 2-[2-hydroxy-3-[4-(2-hydroxyethyl)-1-piperazinyl]propoxy]-9-xanthenone IUPAC Name: 2-[2-hydroxy-3-[4-(2-hydroxyethyl)piperazin-1-yl]propoxy]xanthen-9-one Traditional Name: 2-[2-hydroxy-3-[4-(2-hydroxyethyl)piperazino]propoxy]xanthone Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)CC(COC2=CC3=C(C=C2)OC4=CC=CC=C4C3=O)O

Isomeric SMILES

C1CN(CCN1CCO)CC(COC2=CC3=C(C=C2)OC4=CC=CC=C4C3=O)O

InChI

InChI=1S/C22H26N2O5/c25-12-11-23-7-9-24(10-8-23)14-16(26)15-28-17-5-6-21-19(13-17)22(27)18-3-1-2-4-20(18)29-21/h1-6,13,16,25-26H,7-12,14-15H2