[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-[(4-tert-butylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-[(4-tert-butylphenyl)sulfonylamino]propanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-[(4-tert-butylphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-tert-butylphenyl)sulfonylamino]propanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-[(4-tert-butylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-tert-butylphenyl)sulfonylamino]propionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C18H24N2O5S MolecularWeight: 380.45856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)NCC#C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)NCC#C

InChI

InChI=1S/C18H24N2O5S/c1-5-11-19-16(21)13-25-17(22)10-12-20-26(23,24)15-8-6-14(7-9-15)18(2,3)4/h1,6-9,20H,10-13H2,2-4H3,(H,19,21)