methyl 2-[[2-nitro-3-(phenylsulfonyl)phenyl]amino]ethanoate

Systemtic Name: methyl 2-[[2-nitro-3-(phenylsulfonyl)phenyl]amino]ethanoate Openeye Name: methyl 2-[3-(benzenesulfonyl)-2-nitro-anilino]acetate CAS Name: 2-[3-(benzenesulfonyl)-2-nitroanilino]acetic acid methyl ester IUPAC Name: methyl 2-[3-(benzenesulfonyl)-2-nitroanilino]acetate Traditional Name: 2-(3-besyl-2-nitro-anilino)acetic acid methyl ester Formula: C15H14N2O6S MolecularWeight: 350.34646

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC1=C(C(=CC=C1)S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CNC1=C(C(=CC=C1)S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O6S/c1-23-14(18)10-16-12-8-5-9-13(15(12)17(19)20)24(21,22)11-6-3-2-4-7-11/h2-9,16H,10H2,1H3