3-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]-2-oxidanyl-chromen-4-one

Systemtic Name: 3-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]-2-oxidanyl-chromen-4-one Openeye Name: 2-hydroxy-3-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]chromen-4-one CAS Name: 2-hydroxy-3-[[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]methyl]-1-benzopyran-4-one IUPAC Name: 2-hydroxy-3-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]chromen-4-one Traditional Name: 2-hydroxy-3-[[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]methyl]chromone Formula: C16H22N2O4+2 MolecularWeight: 306.35688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCO)CC2=C(OC3=CC=CC=C3C2=O)O

Isomeric SMILES

C1C[NH+](CC[NH+]1CCO)CC2=C(OC3=CC=CC=C3C2=O)O

InChI

InChI=1S/C16H20N2O4/c19-10-9-17-5-7-18(8-6-17)11-13-15(20)12-3-1-2-4-14(12)22-16(13)21/h1-4,19,21H,5-11H2/p+2