O1-dodecyl O5-(4-nitrophenyl) 2-[2,3-bis(oxidanyl)propoxy]pentanedioate

Systemtic Name: O1-dodecyl O5-(4-nitrophenyl) 2-[2,3-bis(oxidanyl)propoxy]pentanedioate Openeye Name: O1-dodecyl O5-(4-nitrophenyl) 2-(2,3-dihydroxypropoxy)pentanedioate CAS Name: 2-(2,3-dihydroxypropoxy)pentanedioic acid O1-dodecyl ester O5-(4-nitrophenyl) ester IUPAC Name: 1-O-dodecyl 5-O-(4-nitrophenyl) 2-(2,3-dihydroxypropoxy)pentanedioate Traditional Name: 2-glyceryloxyglutaric acid O1-lauryl ester O5-(4-nitrophenyl) ester Formula: C26H41NO9 MolecularWeight: 511.60504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(CCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])OCC(CO)O

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C(CCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])OCC(CO)O

InChI

InChI=1S/C26H41NO9/c1-2-3-4-5-6-7-8-9-10-11-18-34-26(31)24(35-20-22(29)19-28)16-17-25(30)36-23-14-12-21(13-15-23)27(32)33/h12-15,22,24,28-29H,2-11,16-20H2,1H3