trisodium [(Z)-1-(4-chlorophenyl)sulfanyl-2-(6-oxidanidylnaphthalen-2-yl)prop-1-enyl] phosphate

Systemtic Name: trisodium [(Z)-1-(4-chlorophenyl)sulfanyl-2-(6-oxidanidylnaphthalen-2-yl)prop-1-enyl] phosphate Openeye Name: trisodium [(Z)-1-(4-chlorophenyl)sulfanyl-2-(6-oxido-2-naphthyl)prop-1-enyl] phosphate CAS Name: trisodium [(Z)-1-[(4-chlorophenyl)thio]-2-(6-oxido-2-naphthalenyl)prop-1-enyl] phosphate IUPAC Name: trisodium [(Z)-1-(4-chlorophenyl)sulfanyl-2-(6-oxidonaphthalen-2-yl)prop-1-enyl] phosphate Traditional Name: trisodium [(Z)-1-[(4-chlorophenyl)thio]-2-(6-oxido-2-naphthyl)prop-1-enyl] phosphate Formula: C19H13ClNa3O5PS MolecularWeight: 488.764591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(OP(=O)([O-])[O-])SC1=CC=C(C=C1)Cl)C2=CC3=C(C=C2)C=C(C=C3)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C/C(=C(\OP(=O)([O-])[O-])/SC1=CC=C(C=C1)Cl)/C2=CC3=C(C=C2)C=C(C=C3)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C19H16ClO5PS.3Na/c1-12(13-2-3-15-11-17(21)7-4-14(15)10-13)19(25-26(22,23)24)27-18-8-5-16(20)6-9-18;;;/h2-11,21H,1H3,(H2,22,23,24);;;/q;3*+1/p-3/b19-12-;;;