tris[2-(1-methylcyclohexa-2,4-dien-1-yl)ethyl] phosphate

Systemtic Name: tris[2-(1-methylcyclohexa-2,4-dien-1-yl)ethyl] phosphate Openeye Name: tris[2-(1-methylcyclohexa-2,4-dien-1-yl)ethyl] phosphate CAS Name: phosphoric acid tris[2-(1-methyl-1-cyclohexa-2,4-dienyl)ethyl] ester IUPAC Name: tris[2-(1-methylcyclohexa-2,4-dien-1-yl)ethyl] phosphate Traditional Name: phosphoric acid tris[2-(1-methylcyclohexa-2,4-dien-1-yl)ethyl] ester Formula: C27H39O4P MolecularWeight: 458.569921

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=CC=C1)CCOP(=O)(OCCC2(CC=CC=C2)C)OCCC3(CC=CC=C3)C

Isomeric SMILES

CC1(CC=CC=C1)CCOP(=O)(OCCC2(CC=CC=C2)C)OCCC3(CC=CC=C3)C

InChI

InChI=1S/C27H39O4P/c1-25(13-7-4-8-14-25)19-22-29-32(28,30-23-20-26(2)15-9-5-10-16-26)31-24-21-27(3)17-11-6-12-18-27/h4-13,15,17H,14,16,18-24H2,1-3H3