methyl 3-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]propanoate

Systemtic Name: methyl 3-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]propanoate Openeye Name: methyl 3-[(4-acetamido-3-chloro-phenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetamido-3-chlorophenyl)sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 3-[(4-acetamido-3-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetamido-3-chloro-phenyl)sulfonylamino]propionic acid methyl ester Formula: C12H15ClN2O5S MolecularWeight: 334.7759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)OC)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)OC)Cl

InChI

InChI=1S/C12H15ClN2O5S/c1-8(16)15-11-4-3-9(7-10(11)13)21(18,19)14-6-5-12(17)20-2/h3-4,7,14H,5-6H2,1-2H3,(H,15,16)