4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[(4-ethyl-1-piperazine-1,4-diiumyl)methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-hydroxy-8-methyl-coumarin Formula: C17H24N2O3+2 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O3/c1-3-18-6-8-19(9-7-18)11-13-10-16(21)22-17-12(2)15(20)5-4-14(13)17/h4-5,10,20H,3,6-9,11H2,1-2H3/p+2