2-[(2-methoxy-5-nitro-phenyl)-(phenylsulfonyl)amino]ethanoic acid

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)-(phenylsulfonyl)amino]ethanoic acid Openeye Name: 2-[N-(benzenesulfonyl)-2-methoxy-5-nitro-anilino]acetic acid CAS Name: 2-[N-(benzenesulfonyl)-2-methoxy-5-nitroanilino]acetic acid IUPAC Name: 2-[N-(benzenesulfonyl)-2-methoxy-5-nitroanilino]acetic acid Traditional Name: 2-(N-besyl-2-methoxy-5-nitro-anilino)acetic acid Formula: C15H14N2O7S MolecularWeight: 366.34586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O7S/c1-24-14-8-7-11(17(20)21)9-13(14)16(10-15(18)19)25(22,23)12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,19)