benzene; 2-diphenylphosphanylethyl-(3-methylbutyl)-phenyl-phosphanium; methanoate

Systemtic Name: benzene; 2-diphenylphosphanylethyl-(3-methylbutyl)-phenyl-phosphanium; methanoate Openeye Name: benzene; 2-diphenylphosphanylethyl-isopentyl-phenyl-phosphonium; formate CAS Name: benzene; 2-diphenylphosphinoethyl-(3-methylbutyl)-phenylphosphonium; formate IUPAC Name: benzene; 2-diphenylphosphanylethyl-(3-methylbutyl)-phenylphosphanium; formate Traditional Name: benzene; 2-diphenylphosphinoethyl-isoamyl-phenyl-phosphonium; formate Formula: C32H38O2P2 MolecularWeight: 516.590442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[PH+](CCP(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=CC=C1.C(=O)[O-]

Isomeric SMILES

CC(C)CC[PH+](CCP(C1=CC=CC=C1)C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=CC=C1.C(=O)[O-]

InChI

InChI=1S/C25H30P2.C6H6.CH2O2/c1-22(2)18-19-26(23-12-6-3-7-13-23)20-21-27(24-14-8-4-9-15-24)25-16-10-5-11-17-25;1-2-4-6-5-3-1;2-1-3/h3-17,22H,18-21H2,1-2H3;1-6H;1H,(H,2,3)