[4-(4-nitrophenyl)sulfanylcarbonylphenyl] tridecanoate

Systemtic Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] tridecanoate Openeye Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] tridecanoate CAS Name: tridecanoic acid [4-[[(4-nitrophenyl)thio]-oxomethyl]phenyl] ester IUPAC Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] tridecanoate Traditional Name: tridecanoic acid [4-[(4-nitrophenyl)thio]carbonylphenyl] ester Formula: C26H33NO5S MolecularWeight: 471.60892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C26H33NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-25(28)32-23-17-13-21(14-18-23)26(29)33-24-19-15-22(16-20-24)27(30)31/h13-20H,2-12H2,1H3