[4-[(E)-2-nitroethenyl]phenyl] 4-(tert-butylcarbamoyl)benzenesulfonate

Systemtic Name: [4-[(E)-2-nitroethenyl]phenyl] 4-(tert-butylcarbamoyl)benzenesulfonate Openeye Name: [4-[(E)-2-nitrovinyl]phenyl] 4-(tert-butylcarbamoyl)benzenesulfonate CAS Name: 4-[(tert-butylamino)-oxomethyl]benzenesulfonic acid [4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-nitroethenyl]phenyl] 4-(tert-butylcarbamoyl)benzenesulfonate Traditional Name: 4-(tert-butylcarbamoyl)benzenesulfonic acid [4-[(E)-2-nitrovinyl]phenyl] ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)/C=C/[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O6S/c1-19(2,3)20-18(22)15-6-10-17(11-7-15)28(25,26)27-16-8-4-14(5-9-16)12-13-21(23)24/h4-13H,1-3H3,(H,20,22)/b13-12+