octan-3-yl [2-(2,4,4-trimethylpentan-2-yl)phenyl] phosphate

Systemtic Name: octan-3-yl [2-(2,4,4-trimethylpentan-2-yl)phenyl] phosphate Openeye Name: 1-ethylhexyl [2-(1,1,3,3-tetramethylbutyl)phenyl] phosphate CAS Name: octan-3-yl [2-(2,4,4-trimethylpentan-2-yl)phenyl] phosphate IUPAC Name: octan-3-yl [2-(2,4,4-trimethylpentan-2-yl)phenyl] phosphate Traditional Name: 1-ethylhexyl [2-(1,1,3,3-tetramethylbutyl)phenyl] phosphate Formula: C22H38O4P- MolecularWeight: 397.508481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OP(=O)([O-])OC1=CC=CC=C1C(C)(C)CC(C)(C)C

Isomeric SMILES

CCCCCC(CC)OP(=O)([O-])OC1=CC=CC=C1C(C)(C)CC(C)(C)C

InChI

InChI=1S/C22H39O4P/c1-8-10-11-14-18(9-2)25-27(23,24)26-20-16-13-12-15-19(20)22(6,7)17-21(3,4)5/h12-13,15-16,18H,8-11,14,17H2,1-7H3,(H,23,24)/p-1