6-methoxy-3-[4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]phenyl]chromen-2-one

Systemtic Name: 6-methoxy-3-[4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethoxy]phenyl]chromen-2-one Openeye Name: 6-methoxy-3-[4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]phenyl]chromen-2-one CAS Name: 6-methoxy-3-[4-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethoxy]phenyl]-1-benzopyran-2-one IUPAC Name: 6-methoxy-3-[4-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethoxy]phenyl]chromen-2-one Traditional Name: 3-[4-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethoxy]phenyl]-6-methoxy-coumarin Formula: C23H25N2O5+ MolecularWeight: 409.455

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)COC2=CC=C(C=C2)C3=CC4=C(C=CC(=C4)OC)OC3=O

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)COC2=CC=C(C=C2)C3=CC4=C(C=CC(=C4)OC)OC3=O

InChI

InChI=1S/C23H24N2O5/c1-24-9-11-25(12-10-24)22(26)15-29-18-5-3-16(4-6-18)20-14-17-13-19(28-2)7-8-21(17)30-23(20)27/h3-8,13-14H,9-12,15H2,1-2H3/p+1