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

Systemtic Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-oxidanyl-chromen-2-one Openeye Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-chromen-2-one CAS Name: 4-[(4-ethyl-1-piperazine-1,4-diiumyl)methyl]-6-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxychromen-2-one Traditional Name: 4-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-coumarin Formula: C16H22N2O3+2 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O3/c1-2-17-5-7-18(8-6-17)11-12-9-16(20)21-15-4-3-13(19)10-14(12)15/h3-4,9-10,19H,2,5-8,11H2,1H3/p+2