[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] 3-[[(E)-styryl]sulfonylamino]propanoate CAS Name: 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 3-[[(E)-2-phenylethenyl]sulfonylamino]propanoate Traditional Name: 3-[[(E)-styryl]sulfonylamino]propionic acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H25N3O6S MolecularWeight: 411.4726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)COC(=O)CCNS(=O)(=O)C=CC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)COC(=O)CCNS(=O)(=O)/C=C/C1=CC=CC=C1

InChI

InChI=1S/C18H25N3O6S/c1-18(2,3)21-17(24)20-15(22)13-27-16(23)9-11-19-28(25,26)12-10-14-7-5-4-6-8-14/h4-8,10,12,19H,9,11,13H2,1-3H3,(H2,20,21,22,24)/b12-10+