5-methoxy-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxidanylidene-2-phenyl-chromen-7-olate

Systemtic Name: 5-methoxy-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxidanylidene-2-phenyl-chromen-7-olate Openeye Name: 5-methoxy-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-2-phenyl-chromen-7-olate CAS Name: 5-methoxy-8-[(4-methyl-1-piperazin-1-iumyl)methyl]-4-oxo-2-phenyl-1-benzopyran-7-olate IUPAC Name: 5-methoxy-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-4-oxo-2-phenylchromen-7-olate Traditional Name: 4-keto-5-methoxy-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-2-phenyl-chromen-7-olate Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CC2=C3C(=C(C=C2[O-])OC)C(=O)C=C(O3)C4=CC=CC=C4

Isomeric SMILES

CN1CC[NH+](CC1)CC2=C3C(=C(C=C2[O-])OC)C(=O)C=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2O4/c1-23-8-10-24(11-9-23)14-16-17(25)12-20(27-2)21-18(26)13-19(28-22(16)21)15-6-4-3-5-7-15/h3-7,12-13,25H,8-11,14H2,1-2H3