[4-(4-nitrophenyl)sulfanylcarbonylphenyl] propanoate

Systemtic Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] propanoate Openeye Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] propanoate CAS Name: propanoic acid [4-[[(4-nitrophenyl)thio]-oxomethyl]phenyl] ester IUPAC Name: [4-(4-nitrophenyl)sulfanylcarbonylphenyl] propanoate Traditional Name: propionic acid [4-[(4-nitrophenyl)thio]carbonylphenyl] ester Formula: C16H13NO5S MolecularWeight: 331.34312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO5S/c1-2-15(18)22-13-7-3-11(4-8-13)16(19)23-14-9-5-12(6-10-14)17(20)21/h3-10H,2H2,1H3