3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-6-methyl-chromen-4-one

Systemtic Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-6-methyl-chromen-4-one Openeye Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-6-methyl-chromen-4-one CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)methyl]-6-methyl-1-benzopyran-4-one IUPAC Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-6-methylchromen-4-one Traditional Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]-6-methyl-chromone Formula: C17H23N2O2+ MolecularWeight: 287.37672

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=COC3=C(C2=O)C=C(C=C3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=COC3=C(C2=O)C=C(C=C3)C

InChI

InChI=1S/C17H22N2O2/c1-3-18-6-8-19(9-7-18)11-14-12-21-16-5-4-13(2)10-15(16)17(14)20/h4-5,10,12H,3,6-9,11H2,1-2H3/p+1