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

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-oxidanyl-chromen-4-one Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-hydroxy-chromen-4-one CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-ethyl-1-piperazine-1,4-diiumyl)methyl]-7-hydroxy-1-benzopyran-4-one IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-hydroxychromen-4-one Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-8-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-hydroxy-chromone Formula: C24H28N2O5+2 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC5=C(C=C4)OCCO5)O

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC5=C(C=C4)OCCO5)O

InChI

InChI=1S/C24H26N2O5/c1-2-25-7-9-26(10-8-25)14-18-20(27)5-4-17-23(28)19(15-31-24(17)18)16-3-6-21-22(13-16)30-12-11-29-21/h3-6,13,15,27H,2,7-12,14H2,1H3/p+2