8-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-ium-1-yl]methyl]-7-oxidanyl-3-phenyl-chromen-4-one

Systemtic Name: 8-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-ium-1-yl]methyl]-7-oxidanyl-3-phenyl-chromen-4-one Openeye Name: 8-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-ium-1-yl]methyl]-7-hydroxy-3-phenyl-chromen-4-one CAS Name: 8-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-piperazin-1-iumyl]methyl]-7-hydroxy-3-phenyl-1-benzopyran-4-one IUPAC Name: 8-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-ium-1-yl]methyl]-7-hydroxy-3-phenylchromen-4-one Traditional Name: 8-[[4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazin-1-ium-1-yl]methyl]-7-hydroxy-3-phenyl-chromone Formula: C28H27N2O5+ MolecularWeight: 471.52438

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O)C5=CC6=C(C=C5)OCCO6

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O)C5=CC6=C(C=C5)OCCO6

InChI

InChI=1S/C28H26N2O5/c31-24-8-7-21-27(32)23(19-4-2-1-3-5-19)18-35-28(21)22(24)17-29-10-12-30(13-11-29)20-6-9-25-26(16-20)34-15-14-33-25/h1-9,16,18,31H,10-15,17H2/p+1