(2-methoxyphenyl) 3-(4-nitrophenyl)sulfanylpropanoate

Systemtic Name: (2-methoxyphenyl) 3-(4-nitrophenyl)sulfanylpropanoate Openeye Name: (2-methoxyphenyl) 3-(4-nitrophenyl)sulfanylpropanoate CAS Name: 3-[(4-nitrophenyl)thio]propanoic acid (2-methoxyphenyl) ester IUPAC Name: (2-methoxyphenyl) 3-(4-nitrophenyl)sulfanylpropanoate Traditional Name: 3-[(4-nitrophenyl)thio]propionic acid (2-methoxyphenyl) ester Formula: C16H15NO5S MolecularWeight: 333.359

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC(=O)CCSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1OC(=O)CCSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO5S/c1-21-14-4-2-3-5-15(14)22-16(18)10-11-23-13-8-6-12(7-9-13)17(19)20/h2-9H,10-11H2,1H3