carbon monoxide; (4,7-dimethyl-6-oxidaniumyl-1,3-benzodioxol-5-yl)oxidanium; rhenium; triphenylphosphanium

Systemtic Name: carbon monoxide; (4,7-dimethyl-6-oxidaniumyl-1,3-benzodioxol-5-yl)oxidanium; rhenium; triphenylphosphanium Openeye Name: carbon monoxide; (4,7-dimethyl-6-oxonio-1,3-benzodioxol-5-yl)oxonium; rhenium; triphenylphosphonium CAS Name: carbon monoxide; (4,7-dimethyl-6-oxonio-1,3-benzodioxol-5-yl)oxonium; rhenium; triphenylphosphonium IUPAC Name: carbon monoxide; (4,7-dimethyl-6-oxonio-1,3-benzodioxol-5-yl)oxidanium; rhenium; triphenylphosphanium Traditional Name: carbon monoxide; (4,7-dimethyl-6-oxonio-1,3-benzodioxol-5-yl)oxonium; rhenium; triphenylphosphonium Formula: C30H28O7PRe+3 MolecularWeight: 717.719881

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1[OH2+])[OH2+])C)OCO2.[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Re]

Isomeric SMILES

CC1=C2C(=C(C(=C1[OH2+])[OH2+])C)OCO2.[C-]#[O+].[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Re]

InChI

InChI=1S/C18H15P.C9H10O4.3CO.Re/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-4-6(10)7(11)5(2)9-8(4)12-3-13-9;3*1-2;/h1-15H;10-11H,3H2,1-2H3;;;;/p+3