(4-chlorophenyl)-bis(oxidanyl)-sulfanylidene-$l^{5}-phosphane; 5-nitro-8-oxidanyl-9-oxidanylidene-xanthene-3-carbonitrile

Systemtic Name: (4-chlorophenyl)-bis(oxidanyl)-sulfanylidene-$l^{5}-phosphane; 5-nitro-8-oxidanyl-9-oxidanylidene-xanthene-3-carbonitrile Openeye Name: (4-chlorophenyl)-dihydroxy-thioxo-$l^{5}-phosphane; 8-hydroxy-5-nitro-9-oxo-xanthene-3-carbonitrile CAS Name: (4-chlorophenyl)-dihydroxy-sulfanylidenephosphorane; 8-hydroxy-5-nitro-9-oxo-3-xanthenecarbonitrile IUPAC Name: (4-chlorophenyl)-dihydroxy-sulfanylidene-$l^{5}-phosphane; 8-hydroxy-5-nitro-9-oxoxanthene-3-carbonitrile Traditional Name: (4-chlorophenyl)-dihydroxy-thioxo-phosphorane; 8-hydroxy-9-keto-5-nitro-xanthene-3-carbonitrile Formula: C20H12ClN2O7PS MolecularWeight: 490.810241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1P(=S)(O)O)Cl.C1=CC2=C(C=C1C#N)OC3=C(C=CC(=C3C2=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1P(=S)(O)O)Cl.C1=CC2=C(C=C1C#N)OC3=C(C=CC(=C3C2=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H6N2O5.C6H6ClO2PS/c15-6-7-1-2-8-11(5-7)21-14-9(16(19)20)3-4-10(17)12(14)13(8)18;7-5-1-3-6(4-2-5)10(8,9)11/h1-5,17H;1-4H,(H2,8,9,11)