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

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 3-[(4-bromophenyl)sulfonylamino]propanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-[(4-bromophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-bromophenyl)sulfonylamino]propanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 3-[(4-bromophenyl)sulfonylamino]propanoate Traditional Name: 3-(brosylamino)propionic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C14H15BrN2O5S MolecularWeight: 403.2483

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)CCNS(=O)(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

C#CCNC(=O)COC(=O)CCNS(=O)(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C14H15BrN2O5S/c1-2-8-16-13(18)10-22-14(19)7-9-17-23(20,21)12-5-3-11(15)4-6-12/h1,3-6,17H,7-10H2,(H,16,18)