[2-(4-isothiocyanatophenyl)-1-phosphonato-ethyl]-bis(oxidanidyl)-oxidanylidene-$l^{5}-phosphane

Systemtic Name: [2-(4-isothiocyanatophenyl)-1-phosphonato-ethyl]-bis(oxidanidyl)-oxidanylidene-$l^{5}-phosphane Openeye Name: [2-(4-isothiocyanatophenyl)-1-phosphonato-ethyl]-dioxido-oxo-$l^{5}-phosphane CAS Name: [2-(4-isothiocyanatophenyl)-1-phosphonatoethyl]-dioxido-oxophosphorane IUPAC Name: [2-(4-isothiocyanatophenyl)-1-phosphonatoethyl]-dioxido-oxo-$l^{5}-phosphane Traditional Name: [2-(4-isothiocyanatophenyl)-1-phosphonato-ethyl]-keto-dioxido-phosphorane Formula: C9H7NO6P2S-4 MolecularWeight: 319.167502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(P(=O)([O-])[O-])P(=O)([O-])[O-])N=C=S

Isomeric SMILES

C1=CC(=CC=C1CC(P(=O)([O-])[O-])P(=O)([O-])[O-])N=C=S

InChI

InChI=1S/C9H11NO6P2S/c11-17(12,13)9(18(14,15)16)5-7-1-3-8(4-2-7)10-6-19/h1-4,9H,5H2,(H2,11,12,13)(H2,14,15,16)/p-4