O1-(2,3-didodecoxypropyl) O5-(4-nitrosulfanylphenyl) pentanedioate

Systemtic Name: O1-(2,3-didodecoxypropyl) O5-(4-nitrosulfanylphenyl) pentanedioate Openeye Name: O1-(2,3-didodecoxypropyl) O5-(4-nitrosulfanylphenyl) pentanedioate CAS Name: pentanedioic acid O1-(2,3-didodecoxypropyl) ester O5-[4-(nitrothio)phenyl] ester IUPAC Name: 1-O-(2,3-didodecoxypropyl) 5-O-(4-nitrosulfanylphenyl) pentanedioate Traditional Name: glutaric acid O1-(2,3-dilauryloxypropyl) ester O5-[4-(nitrothio)phenyl] ester Formula: C38H65NO8S MolecularWeight: 695.9896

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOCC(COC(=O)CCCC(=O)OC1=CC=C(C=C1)S[N+](=O)[O-])OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOCC(COC(=O)CCCC(=O)OC1=CC=C(C=C1)S[N+](=O)[O-])OCCCCCCCCCCCC

InChI

InChI=1S/C38H65NO8S/c1-3-5-7-9-11-13-15-17-19-21-30-44-32-35(45-31-22-20-18-16-14-12-10-8-6-4-2)33-46-37(40)24-23-25-38(41)47-34-26-28-36(29-27-34)48-39(42)43/h26-29,35H,3-25,30-33H2,1-2H3