ethyl 2-[(3-nitrophenyl)-(phenylsulfonyl)amino]propanoate

Systemtic Name: ethyl 2-[(3-nitrophenyl)-(phenylsulfonyl)amino]propanoate Openeye Name: ethyl 2-[N-(benzenesulfonyl)-3-nitro-anilino]propanoate CAS Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[N-(benzenesulfonyl)-3-nitroanilino]propanoate Traditional Name: 2-(N-besyl-3-nitro-anilino)propionic acid ethyl ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O6S/c1-3-25-17(20)13(2)18(14-8-7-9-15(12-14)19(21)22)26(23,24)16-10-5-4-6-11-16/h4-13H,3H2,1-2H3