8-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-7-oxidanyl-2-phenyl-chromen-4-one

Systemtic Name: 8-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-7-oxidanyl-2-phenyl-chromen-4-one Openeye Name: 7-hydroxy-8-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-2-phenyl-chromen-4-one CAS Name: 7-hydroxy-8-[[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]methyl]-5-methoxy-2-phenyl-1-benzopyran-4-one IUPAC Name: 7-hydroxy-8-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-2-phenylchromen-4-one Traditional Name: 7-hydroxy-8-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-5-methoxy-2-phenyl-chromone Formula: C23H27N2O5+ MolecularWeight: 411.47088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C2=C1C(=O)C=C(O2)C3=CC=CC=C3)C[NH+]4CCN(CC4)CCO)O

Isomeric SMILES

COC1=CC(=C(C2=C1C(=O)C=C(O2)C3=CC=CC=C3)C[NH+]4CCN(CC4)CCO)O

InChI

InChI=1S/C23H26N2O5/c1-29-21-13-18(27)17(15-25-9-7-24(8-10-25)11-12-26)23-22(21)19(28)14-20(30-23)16-5-3-2-4-6-16/h2-6,13-14,26-27H,7-12,15H2,1H3/p+1