methyl 2-[4-(4-methylsulfonyl-2-nitro-phenoxy)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(4-methylsulfonyl-2-nitro-phenoxy)phenyl]ethanoate Openeye Name: methyl 2-[4-(4-methylsulfonyl-2-nitro-phenoxy)phenyl]acetate CAS Name: 2-[4-(4-methylsulfonyl-2-nitrophenoxy)phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(4-methylsulfonyl-2-nitrophenoxy)phenyl]acetate Traditional Name: 2-[4-(4-mesyl-2-nitro-phenoxy)phenyl]acetic acid methyl ester Formula: C16H15NO7S MolecularWeight: 365.3578

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO7S/c1-23-16(18)9-11-3-5-12(6-4-11)24-15-8-7-13(25(2,21)22)10-14(15)17(19)20/h3-8,10H,9H2,1-2H3