barium(2+); 6-oxidanidyl-8-(phenylmethyl)benzo[c][1,2]benzoxaphosphinine 6-oxide

Systemtic Name: barium(2+); 6-oxidanidyl-8-(phenylmethyl)benzo[c][1,2]benzoxaphosphinine 6-oxide Openeye Name: barium(2+); 8-benzyl-6-oxido-benzo[c][1,2]benzoxaphosphinine 6-oxide CAS Name: barium(2+); 6-oxido-8-(phenylmethyl)benzo[c][1,2]benzoxaphosphorin 6-oxide IUPAC Name: barium(2+); 8-benzyl-6-oxidobenzo[c][1,2]benzoxaphosphinine 6-oxide Traditional Name: barium(2+); 8-benzyl-6-oxido-benzo[c][1,2]benzoxaphosphorin 6-oxide Formula: C38H28BaO6P2 MolecularWeight: 779.899842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC3=C(C=C2)C4=CC=CC=C4OP3(=O)[O-].C1=CC=C(C=C1)CC2=CC3=C(C=C2)C4=CC=CC=C4OP3(=O)[O-].[Ba+2]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC3=C(C=C2)C4=CC=CC=C4OP3(=O)[O-].C1=CC=C(C=C1)CC2=CC3=C(C=C2)C4=CC=CC=C4OP3(=O)[O-].[Ba+2]

InChI

InChI=1S/2C19H15O3P.Ba/c2*20-23(21)19-13-15(12-14-6-2-1-3-7-14)10-11-17(19)16-8-4-5-9-18(16)22-23;/h2*1-11,13H,12H2,(H,20,21);/q;;+2/p-2