cyanomethyl 3-[(3-bromophenyl)sulfonylamino]propanoate

Systemtic Name: cyanomethyl 3-[(3-bromophenyl)sulfonylamino]propanoate Openeye Name: cyanomethyl 3-[(3-bromophenyl)sulfonylamino]propanoate CAS Name: 3-[(3-bromophenyl)sulfonylamino]propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-[(3-bromophenyl)sulfonylamino]propanoate Traditional Name: 3-[(3-bromophenyl)sulfonylamino]propionic acid cyanomethyl ester Formula: C11H11BrN2O4S MolecularWeight: 347.18504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)S(=O)(=O)NCCC(=O)OCC#N

Isomeric SMILES

C1=CC(=CC(=C1)Br)S(=O)(=O)NCCC(=O)OCC#N

InChI

InChI=1S/C11H11BrN2O4S/c12-9-2-1-3-10(8-9)19(16,17)14-6-4-11(15)18-7-5-13/h1-3,8,14H,4,6-7H2