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2-methylpropyl 2-(phosphonooxymethyl)benzoate

2-methylpropyl 2-(phosphonooxymethyl)benzoate

Systemtic Name:2-methylpropyl 2-(phosphonooxymethyl)benzoate
Openeye Name:isobutyl 2-(phosphonooxymethyl)benzoate
CAS Name:2-(phosphonooxymethyl)benzoic acid 2-methylpropyl ester
IUPAC Name:2-methylpropyl 2-(phosphonooxymethyl)benzoate
Traditional Name:2-(phosphonooxymethyl)benzoic acid isobutyl ester
Formula: C12H17O6P
MolecularWeight: 288.233541
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=CC=C1COP(=O)(O)O


Isomeric SMILES

CC(C)COC(=O)C1=CC=CC=C1COP(=O)(O)O


InChI

InChI=1S/C12H17O6P/c1-9(2)7-17-12(13)11-6-4-3-5-10(11)8-18-19(14,15)16/h3-6,9H,7-8H2,1-2H3,(H2,14,15,16)


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