bis[(2S)-2-methylbutyl] (5-methylcyclohexa-1,5-dien-1-yl) phosphate

Systemtic Name: bis[(2S)-2-methylbutyl] (5-methylcyclohexa-1,5-dien-1-yl) phosphate Openeye Name: bis[(2S)-2-methylbutyl] (5-methylcyclohexa-1,5-dien-1-yl) phosphate CAS Name: phosphoric acid bis[(2S)-2-methylbutyl] (5-methyl-1-cyclohexa-1,5-dienyl) ester IUPAC Name: bis[(2S)-2-methylbutyl] (5-methylcyclohexa-1,5-dien-1-yl) phosphate Traditional Name: phosphoric acid bis[(2S)-2-methylbutyl] (5-methylcyclohexa-1,5-dien-1-yl) ester Formula: C17H31O4P MolecularWeight: 330.399401

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COP(=O)(OCC(C)CC)OC1=CCCC(=C1)C

Isomeric SMILES

CC[C@H](C)COP(=O)(OC[C@@H](C)CC)OC1=CCCC(=C1)C

InChI

InChI=1S/C17H31O4P/c1-6-14(3)12-19-22(18,20-13-15(4)7-2)21-17-10-8-9-16(5)11-17/h10-11,14-15H,6-9,12-13H2,1-5H3/t14-,15-/m0/s1