[4-[4-(4-nitrophenyl)sulfanylcarbonylphenyl]phenyl] heptanoate

Systemtic Name: [4-[4-(4-nitrophenyl)sulfanylcarbonylphenyl]phenyl] heptanoate Openeye Name: [4-[4-(4-nitrophenyl)sulfanylcarbonylphenyl]phenyl] heptanoate CAS Name: heptanoic acid [4-[4-[[(4-nitrophenyl)thio]-oxomethyl]phenyl]phenyl] ester IUPAC Name: [4-[4-(4-nitrophenyl)sulfanylcarbonylphenyl]phenyl] heptanoate Traditional Name: enanthic acid [4-[4-[(4-nitrophenyl)thio]carbonylphenyl]phenyl] ester Formula: C26H25NO5S MolecularWeight: 463.5454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H25NO5S/c1-2-3-4-5-6-25(28)32-23-15-11-20(12-16-23)19-7-9-21(10-8-19)26(29)33-24-17-13-22(14-18-24)27(30)31/h7-18H,2-6H2,1H3