methyl 4-[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanoyloxy]benzoate

Systemtic Name: methyl 4-[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanoyloxy]benzoate Openeye Name: methyl 4-[2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetyl]oxybenzoate CAS Name: 4-[2-[(4-methoxy-3-nitrophenyl)methylthio]-1-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetyl]oxybenzoate Traditional Name: 4-[2-[(4-methoxy-3-nitro-benzyl)thio]acetyl]oxybenzoic acid methyl ester Formula: C18H17NO7S MolecularWeight: 391.39508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSCC(=O)OC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CSCC(=O)OC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17NO7S/c1-24-16-8-3-12(9-15(16)19(22)23)10-27-11-17(20)26-14-6-4-13(5-7-14)18(21)25-2/h3-9H,10-11H2,1-2H3