[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] 3-(2-naphthylsulfonylamino)propanoate CAS Name: 3-(2-naphthalenylsulfonylamino)propanoic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 3-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: 3-(2-naphthylsulfonylamino)propionic acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)COC(=O)CCNS(=O)(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)COC(=O)CCNS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChI

InChI=1S/C20H25N3O6S/c1-20(2,3)23-19(26)22-17(24)13-29-18(25)10-11-21-30(27,28)16-9-8-14-6-4-5-7-15(14)12-16/h4-9,12,21H,10-11,13H2,1-3H3,(H2,22,23,24,26)