[8-(4-methylphenyl)sulfonyloxy-1-[2-[(oxan-3-yloxycarbonylamino)methyl]heptadecoxy]octan-2-yl] ethanoate

Systemtic Name: [8-(4-methylphenyl)sulfonyloxy-1-[2-[(oxan-3-yloxycarbonylamino)methyl]heptadecoxy]octan-2-yl] ethanoate Openeye Name: [7-(p-tolylsulfonyloxy)-1-[2-[(tetrahydropyran-3-yloxycarbonylamino)methyl]heptadecoxymethyl]heptyl] acetate CAS Name: acetic acid [8-(4-methylphenyl)sulfonyloxy-1-[2-[[[3-oxanyloxy(oxo)methyl]amino]methyl]heptadecoxy]octan-2-yl] ester IUPAC Name: [8-(4-methylphenyl)sulfonyloxy-1-[2-[(oxan-3-yloxycarbonylamino)methyl]heptadecoxy]octan-2-yl] acetate Traditional Name: acetic acid [1-[2-[(tetrahydropyran-3-yloxycarbonylamino)methyl]heptadecoxymethyl]-7-tosyloxy-heptyl] ester Formula: C41H71NO9S MolecularWeight: 754.06874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(CNC(=O)OC1CCCOC1)COCC(CCCCCCOS(=O)(=O)C2=CC=C(C=C2)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(CNC(=O)OC1CCCOC1)COCC(CCCCCCOS(=O)(=O)C2=CC=C(C=C2)C)OC(=O)C

InChI

InChI=1S/C41H71NO9S/c1-4-5-6-7-8-9-10-11-12-13-14-15-18-22-37(31-42-41(44)51-39-24-21-29-47-33-39)32-48-34-38(50-36(3)43)23-19-16-17-20-30-49-52(45,46)40-27-25-35(2)26-28-40/h25-28,37-39H,4-24,29-34H2,1-3H3,(H,42,44)