2-oxidanylidene-5-[[2-(phenylmethyl)-3,4-dihydro-2H-chromen-5-yl]methyl]-1,2,3-thiadiazolidin-2-ium-4-one

Systemtic Name: 2-oxidanylidene-5-[[2-(phenylmethyl)-3,4-dihydro-2H-chromen-5-yl]methyl]-1,2,3-thiadiazolidin-2-ium-4-one Openeye Name: 5-[(2-benzylchroman-5-yl)methyl]-2-oxo-thiadiazolidin-2-ium-4-one CAS Name: 2-oxo-5-[[2-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-5-yl]methyl]-4-thiadiazolidin-2-iumone IUPAC Name: 5-[(2-benzyl-3,4-dihydro-2H-chromen-5-yl)methyl]-2-oxothiadiazolidin-2-ium-4-one Traditional Name: 5-[(2-benzylchroman-5-yl)methyl]-2-keto-thiadiazolidin-2-ium-4-one Formula: C19H19N2O3S+ MolecularWeight: 355.43076

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2OC1CC3=CC=CC=C3)CC4C(=O)N[N+](=O)S4

Isomeric SMILES

C1CC2=C(C=CC=C2OC1CC3=CC=CC=C3)CC4C(=O)N[N+](=O)S4

InChI

InChI=1S/C19H18N2O3S/c22-19-18(25-21(23)20-19)12-14-7-4-8-17-16(14)10-9-15(24-17)11-13-5-2-1-3-6-13/h1-8,15,18H,9-12H2/p+1