6-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)chromen-4-one

Systemtic Name: 6-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)chromen-4-one Openeye Name: 6-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)chromen-4-one CAS Name: 6-methyl-3-(4-thiomorpholin-4-iumylmethyl)-1-benzopyran-4-one IUPAC Name: 6-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)chromen-4-one Traditional Name: 6-methyl-3-(thiomorpholin-4-ium-4-ylmethyl)chromone Formula: C15H18NO2S+ MolecularWeight: 276.37392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC=C(C2=O)C[NH+]3CCSCC3

Isomeric SMILES

CC1=CC2=C(C=C1)OC=C(C2=O)C[NH+]3CCSCC3

InChI

InChI=1S/C15H17NO2S/c1-11-2-3-14-13(8-11)15(17)12(10-18-14)9-16-4-6-19-7-5-16/h2-3,8,10H,4-7,9H2,1H3/p+1