3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]chromen-4-one

Systemtic Name: 3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]chromen-4-one Openeye Name: 3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]chromen-4-one CAS Name: 3-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-1-benzopyran-4-one IUPAC Name: 3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]chromen-4-one Traditional Name: 3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]chromone Formula: C15H20N2O2+2 MolecularWeight: 260.3315

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC2=COC3=CC=CC=C3C2=O

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2=COC3=CC=CC=C3C2=O

InChI

InChI=1S/C15H18N2O2/c1-16-6-8-17(9-7-16)10-12-11-19-14-5-3-2-4-13(14)15(12)18/h2-5,11H,6-10H2,1H3/p+2