methyl 4-[3-(2-chloranyl-6-nitro-phenyl)sulfanylpropanoyloxymethyl]benzoate

Systemtic Name: methyl 4-[3-(2-chloranyl-6-nitro-phenyl)sulfanylpropanoyloxymethyl]benzoate Openeye Name: methyl 4-[3-(2-chloro-6-nitro-phenyl)sulfanylpropanoyloxymethyl]benzoate CAS Name: 4-[[3-[(2-chloro-6-nitrophenyl)thio]-1-oxopropoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(2-chloro-6-nitrophenyl)sulfanylpropanoyloxymethyl]benzoate Traditional Name: 4-[3-[(2-chloro-6-nitro-phenyl)thio]propanoyloxymethyl]benzoic acid methyl ester Formula: C18H16ClNO6S MolecularWeight: 409.84074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)CCSC2=C(C=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)CCSC2=C(C=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClNO6S/c1-25-18(22)13-7-5-12(6-8-13)11-26-16(21)9-10-27-17-14(19)3-2-4-15(17)20(23)24/h2-8H,9-11H2,1H3