8-[(4-methylpiperazin-1-ium-1-yl)methyl]-7-oxidanyl-3-phenyl-chromen-4-one

Systemtic Name: 8-[(4-methylpiperazin-1-ium-1-yl)methyl]-7-oxidanyl-3-phenyl-chromen-4-one Openeye Name: 7-hydroxy-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-phenyl-chromen-4-one CAS Name: 7-hydroxy-8-[(4-methyl-1-piperazin-1-iumyl)methyl]-3-phenyl-1-benzopyran-4-one IUPAC Name: 7-hydroxy-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-phenylchromen-4-one Traditional Name: 7-hydroxy-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-3-phenyl-chromone Formula: C21H23N2O3+ MolecularWeight: 351.41892

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O

Isomeric SMILES

CN1CC[NH+](CC1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C21H22N2O3/c1-22-9-11-23(12-10-22)13-17-19(24)8-7-16-20(25)18(14-26-21(16)17)15-5-3-2-4-6-15/h2-8,14,24H,9-13H2,1H3/p+1