[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-[(2-methyl-7-oxidanyl-4-oxidanylidene-3-phenyl-chromen-8-yl)methyl]azanium

Systemtic Name: [(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-[(2-methyl-7-oxidanyl-4-oxidanylidene-3-phenyl-chromen-8-yl)methyl]azanium Openeye Name: [(3S)-1,1-dioxothiolan-3-yl]-[(7-hydroxy-2-methyl-4-oxo-3-phenyl-chromen-8-yl)methyl]-methyl-ammonium CAS Name: [(3S)-1,1-dioxo-3-thiolanyl]-[(7-hydroxy-2-methyl-4-oxo-3-phenyl-1-benzopyran-8-yl)methyl]-methylammonium IUPAC Name: [(3S)-1,1-dioxothiolan-3-yl]-[(7-hydroxy-2-methyl-4-oxo-3-phenylchromen-8-yl)methyl]-methylazanium Traditional Name: [(3S)-1,1-diketothiolan-3-yl]-[(7-hydroxy-4-keto-2-methyl-3-phenyl-chromen-8-yl)methyl]-methyl-ammonium Formula: C22H24NO5S+ MolecularWeight: 414.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+](C)C3CCS(=O)(=O)C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C(=C(C=C2)O)C[NH+](C)[C@H]3CCS(=O)(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23NO5S/c1-14-20(15-6-4-3-5-7-15)21(25)17-8-9-19(24)18(22(17)28-14)12-23(2)16-10-11-29(26,27)13-16/h3-9,16,24H,10-13H2,1-2H3/p+1/t16-/m0/s1