methyl 3-nitro-4-(2-phenylphenoxy)sulfonyl-benzoate

Systemtic Name: methyl 3-nitro-4-(2-phenylphenoxy)sulfonyl-benzoate Openeye Name: methyl 3-nitro-4-(2-phenylphenoxy)sulfonyl-benzoate CAS Name: 3-nitro-4-(2-phenylphenoxy)sulfonylbenzoic acid methyl ester IUPAC Name: methyl 3-nitro-4-(2-phenylphenoxy)sulfonylbenzoate Traditional Name: 3-nitro-4-(2-phenylphenoxy)sulfonyl-benzoic acid methyl ester Formula: C20H15NO7S MolecularWeight: 413.4006

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H15NO7S/c1-27-20(22)15-11-12-19(17(13-15)21(23)24)29(25,26)28-18-10-6-5-9-16(18)14-7-3-2-4-8-14/h2-13H,1H3