4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7,8-dimethyl-chromen-2-one

Systemtic Name: 4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7,8-dimethyl-chromen-2-one Openeye Name: 4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7,8-dimethyl-chromen-2-one CAS Name: 4-[(4-ethyl-1-piperazin-4-iumyl)methyl]-7,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7,8-dimethylchromen-2-one Traditional Name: 4-[(4-ethylpiperazin-4-ium-1-yl)methyl]-7,8-dimethyl-coumarin Formula: C18H25N2O2+ MolecularWeight: 301.4033

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=CC(=O)OC3=C2C=CC(=C3C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=CC(=O)OC3=C2C=CC(=C3C)C

InChI

InChI=1S/C18H24N2O2/c1-4-19-7-9-20(10-8-19)12-15-11-17(21)22-18-14(3)13(2)5-6-16(15)18/h5-6,11H,4,7-10,12H2,1-3H3/p+1