6-fluoranyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-chromen-2-one

Systemtic Name: 6-fluoranyl-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-chromen-2-one Openeye Name: 6-fluoro-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-chromen-2-one CAS Name: 6-fluoro-3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-1-benzopyran-2-one IUPAC Name: 6-fluoro-3-(4-methylpiperazin-4-ium-1-yl)sulfonylchromen-2-one Traditional Name: 6-fluoro-3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-coumarin Formula: C14H16FN2O4S+ MolecularWeight: 327.351243

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC3=C(C=CC(=C3)F)OC2=O

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC3=C(C=CC(=C3)F)OC2=O

InChI

InChI=1S/C14H15FN2O4S/c1-16-4-6-17(7-5-16)22(19,20)13-9-10-8-11(15)2-3-12(10)21-14(13)18/h2-3,8-9H,4-7H2,1H3/p+1