3-(3,4-dimethoxyphenyl)-8-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-oxidanyl-chromen-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-8-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-oxidanyl-chromen-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-8-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-hydroxy-chromen-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-8-[(4-ethyl-1-piperazine-1,4-diiumyl)methyl]-7-hydroxy-1-benzopyran-4-one IUPAC Name: 3-(3,4-dimethoxyphenyl)-8-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-hydroxychromen-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-8-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-hydroxy-chromone Formula: C24H30N2O5+2 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28N2O5/c1-4-25-9-11-26(12-10-25)14-18-20(27)7-6-17-23(28)19(15-31-24(17)18)16-5-8-21(29-2)22(13-16)30-3/h5-8,13,15,27H,4,9-12,14H2,1-3H3/p+2