6-(4-methylpiperazin-4-ium-1-yl)sulfonylchromen-2-one

Systemtic Name: 6-(4-methylpiperazin-4-ium-1-yl)sulfonylchromen-2-one Openeye Name: 6-(4-methylpiperazin-4-ium-1-yl)sulfonylchromen-2-one CAS Name: 6-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-1-benzopyran-2-one IUPAC Name: 6-(4-methylpiperazin-4-ium-1-yl)sulfonylchromen-2-one Traditional Name: 6-(4-methylpiperazin-4-ium-1-yl)sulfonylcoumarin Formula: C14H17N2O4S+ MolecularWeight: 309.36078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O4S/c1-15-6-8-16(9-7-15)21(18,19)12-3-4-13-11(10-12)2-5-14(17)20-13/h2-5,10H,6-9H2,1H3/p+1