trisodium; 2-bis(oxidanidyl)phosphinothioyl-2,3-dihydro-1H-indene-1-carboxylate; methanol

Systemtic Name: trisodium; 2-bis(oxidanidyl)phosphinothioyl-2,3-dihydro-1H-indene-1-carboxylate; methanol Openeye Name: trisodium; 2-dioxidophosphinothioylindane-1-carboxylate; methanol CAS Name: trisodium; 2-dioxidophosphinothioyl-2,3-dihydro-1H-indene-1-carboxylate; methanol IUPAC Name: trisodium; 2-dioxidophosphinothioyl-2,3-dihydro-1H-indene-1-carboxylate; methanol Traditional Name: trisodium; 2-dioxidothiophosphorylindane-1-carboxylate; methanol Formula: C11H12Na3O5PS MolecularWeight: 356.218051

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Descriptors Computed from Structure

Canonical SMILES:

CO.C1C(C(C2=CC=CC=C21)C(=O)[O-])P(=S)([O-])[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CO.C1C(C(C2=CC=CC=C21)C(=O)[O-])P(=S)([O-])[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C10H11O4PS.CH4O.3Na/c11-10(12)9-7-4-2-1-3-6(7)5-8(9)15(13,14)16;1-2;;;/h1-4,8-9H,5H2,(H,11,12)(H2,13,14,16);2H,1H3;;;/q;;3*+1/p-3