tert-butyl 2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanoate

Systemtic Name: tert-butyl 2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanoate Openeye Name: tert-butyl 2-[N-(benzenesulfonyl)-4-nitro-anilino]acetate CAS Name: 2-[N-(benzenesulfonyl)-4-nitroanilino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[N-(benzenesulfonyl)-4-nitroanilino]acetate Traditional Name: 2-(N-besyl-4-nitro-anilino)acetic acid tert-butyl ester Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O6S/c1-18(2,3)26-17(21)13-19(14-9-11-15(12-10-14)20(22)23)27(24,25)16-7-5-4-6-8-16/h4-12H,13H2,1-3H3