barium(2+); (4-chlorophenyl)sulfonyl-diheptoxyphosphoryl-azanide

Systemtic Name: barium(2+); (4-chlorophenyl)sulfonyl-diheptoxyphosphoryl-azanide Openeye Name: barium(2+); (4-chlorophenyl)sulfonyl-diheptoxyphosphoryl-azanide CAS Name: barium(2+); (4-chlorophenyl)sulfonyl-diheptoxyphosphorylazanide IUPAC Name: barium(2+); (4-chlorophenyl)sulfonyl-diheptoxyphosphorylazanide Traditional Name: barium(2+); (4-chlorophenyl)sulfonyl-diheptoxyphosphoryl-azanide Formula: C40H68BaCl2N2O10P2S2 MolecularWeight: 1071.285842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOP(=O)([N-]S(=O)(=O)C1=CC=C(C=C1)Cl)OCCCCCCC.CCCCCCCOP(=O)([N-]S(=O)(=O)C1=CC=C(C=C1)Cl)OCCCCCCC.[Ba+2]

Isomeric SMILES

CCCCCCCOP(=O)([N-]S(=O)(=O)C1=CC=C(C=C1)Cl)OCCCCCCC.CCCCCCCOP(=O)([N-]S(=O)(=O)C1=CC=C(C=C1)Cl)OCCCCCCC.[Ba+2]

InChI

InChI=1S/2C20H34ClNO5PS.Ba/c2*1-3-5-7-9-11-17-26-28(23,27-18-12-10-8-6-4-2)22-29(24,25)20-15-13-19(21)14-16-20;/h2*13-16H,3-12,17-18H2,1-2H3;/q2*-1;+2