[4-(4-nitrophenyl)sulfanylcarbonylphenyl] butanoate

Systemtic Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] butanoate Openeye Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] butanoate CAS Name: butanoic acid [4-[[(4-nitrophenyl)thio]-oxomethyl]phenyl] ester IUPAC Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] butanoate Traditional Name: butyric acid [4-[(4-nitrophenyl)thio]carbonylphenyl] ester Formula: C17H15NO5S MolecularWeight: 345.3697

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO5S/c1-2-3-16(19)23-14-8-4-12(5-9-14)17(20)24-15-10-6-13(7-11-15)18(21)22/h4-11H,2-3H2,1H3