18-(4-nitrophenyl)sulfonyl-17,18,19-tris(oxidanyl)pentatriacontane-16,20-dione

Systemtic Name: 18-(4-nitrophenyl)sulfonyl-17,18,19-tris(oxidanyl)pentatriacontane-16,20-dione Openeye Name: 17,18,19-trihydroxy-18-(4-nitrophenyl)sulfonyl-pentatriacontane-16,20-dione CAS Name: 17,18,19-trihydroxy-18-(4-nitrophenyl)sulfonylpentatriacontane-16,20-dione IUPAC Name: 17,18,19-trihydroxy-18-(4-nitrophenyl)sulfonylpentatriacontane-16,20-dione Traditional Name: 17,18,19-trihydroxy-18-nosyl-pentatriacontane-16,20-dione Formula: C41H71NO9S MolecularWeight: 754.06874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(C(C(=O)CCCCCCCCCCCCCCC)O)(O)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(C(C(=O)CCCCCCCCCCCCCCC)O)(O)S(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])O

InChI

InChI=1S/C41H71NO9S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(43)39(45)41(47,52(50,51)36-33-31-35(32-34-36)42(48)49)40(46)38(44)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-34,39-40,45-47H,3-30H2,1-2H3