2-(4-methoxyphenoxy)ethyl 4-methylsulfonyl-3-nitro-benzoate

Systemtic Name: 2-(4-methoxyphenoxy)ethyl 4-methylsulfonyl-3-nitro-benzoate Openeye Name: 2-(4-methoxyphenoxy)ethyl 4-methylsulfonyl-3-nitro-benzoate CAS Name: 4-methylsulfonyl-3-nitrobenzoic acid 2-(4-methoxyphenoxy)ethyl ester IUPAC Name: 2-(4-methoxyphenoxy)ethyl 4-methylsulfonyl-3-nitrobenzoate Traditional Name: 4-mesyl-3-nitro-benzoic acid 2-(4-methoxyphenoxy)ethyl ester Formula: C17H17NO8S MolecularWeight: 395.38378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCOC(=O)C2=CC(=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)OCCOC(=O)C2=CC(=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H17NO8S/c1-24-13-4-6-14(7-5-13)25-9-10-26-17(19)12-3-8-16(27(2,22)23)15(11-12)18(20)21/h3-8,11H,9-10H2,1-2H3