4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-methyl-6-oxidanyl-chromen-2-one

Systemtic Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-7-methyl-6-oxidanyl-chromen-2-one Openeye Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-7-methyl-chromen-2-one CAS Name: 4-[(4-ethyl-1-piperazine-1,4-diiumyl)methyl]-6-hydroxy-7-methyl-1-benzopyran-2-one IUPAC Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-7-methylchromen-2-one Traditional Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-7-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=CC(=C(C=C23)O)C

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC2=CC(=O)OC3=CC(=C(C=C23)O)C

InChI

InChI=1S/C17H22N2O3/c1-3-18-4-6-19(7-5-18)11-13-9-17(21)22-16-8-12(2)15(20)10-14(13)16/h8-10,20H,3-7,11H2,1-2H3/p+2