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

Systemtic Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]chromen-4-one Openeye Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]chromen-4-one CAS Name: 3-[(4-ethyl-1-piperazin-4-iumyl)methyl]-1-benzopyran-4-one IUPAC Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]chromen-4-one Traditional Name: 3-[(4-ethylpiperazin-4-ium-1-yl)methyl]chromone Formula: C16H21N2O2+ MolecularWeight: 273.35014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O2/c1-2-17-7-9-18(10-8-17)11-13-12-20-15-6-4-3-5-14(15)16(13)19/h3-6,12H,2,7-11H2,1H3/p+1