4-[(2-chloranyl-5-methoxycarbonyl-phenyl)sulfonylamino]butanoic acid

Systemtic Name: 4-[(2-chloranyl-5-methoxycarbonyl-phenyl)sulfonylamino]butanoic acid Openeye Name: 4-[(2-chloro-5-methoxycarbonyl-phenyl)sulfonylamino]butanoic acid CAS Name: 4-[(2-chloro-5-methoxycarbonylphenyl)sulfonylamino]butanoic acid IUPAC Name: 4-[(2-chloro-5-methoxycarbonylphenyl)sulfonylamino]butanoic acid Traditional Name: 4-[(5-carbomethoxy-2-chloro-phenyl)sulfonylamino]butyric acid Formula: C12H14ClNO6S MolecularWeight: 335.76066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NCCCC(=O)O

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)NCCCC(=O)O

InChI

InChI=1S/C12H14ClNO6S/c1-20-12(17)8-4-5-9(13)10(7-8)21(18,19)14-6-2-3-11(15)16/h4-5,7,14H,2-3,6H2,1H3,(H,15,16)