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

Systemtic Name: methyl 4-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]butanoate Openeye Name: methyl 4-[(4-acetamido-3-chloro-phenyl)sulfonylamino]butanoate CAS Name: 4-[(4-acetamido-3-chlorophenyl)sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl 4-[(4-acetamido-3-chlorophenyl)sulfonylamino]butanoate Traditional Name: 4-[(4-acetamido-3-chloro-phenyl)sulfonylamino]butyric acid methyl ester Formula: C13H17ClN2O5S MolecularWeight: 348.80248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17ClN2O5S/c1-9(17)16-12-6-5-10(8-11(12)14)22(19,20)15-7-3-4-13(18)21-2/h5-6,8,15H,3-4,7H2,1-2H3,(H,16,17)