4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-methyl-chromen-2-one

Systemtic Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-methyl-chromen-2-one Openeye Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-methyl-chromen-2-one CAS Name: 4-[(4-ethyl-1-piperazine-1,4-diiumyl)methyl]-6-methyl-1-benzopyran-2-one IUPAC Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-methylchromen-2-one Traditional Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-methyl-coumarin Formula: C17H24N2O2+2 MolecularWeight: 288.38466

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC2=CC(=O)OC3=C2C=C(C=C3)C

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC2=CC(=O)OC3=C2C=C(C=C3)C

InChI

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