2-[(5-chloranyl-2-methyl-phenyl)sulfonyl-(cyclopropylmethyl)amino]ethanoic acid

Systemtic Name: 2-[(5-chloranyl-2-methyl-phenyl)sulfonyl-(cyclopropylmethyl)amino]ethanoic acid Openeye Name: 2-[(5-chloro-2-methyl-phenyl)sulfonyl-(cyclopropylmethyl)amino]acetic acid CAS Name: 2-[(5-chloro-2-methylphenyl)sulfonyl-(cyclopropylmethyl)amino]acetic acid IUPAC Name: 2-[(5-chloro-2-methylphenyl)sulfonyl-(cyclopropylmethyl)amino]acetic acid Traditional Name: 2-[(5-chloro-2-methyl-phenyl)sulfonyl-(cyclopropylmethyl)amino]acetic acid Formula: C13H16ClNO4S MolecularWeight: 317.78844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)S(=O)(=O)N(CC2CC2)CC(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)S(=O)(=O)N(CC2CC2)CC(=O)O

InChI

InChI=1S/C13H16ClNO4S/c1-9-2-5-11(14)6-12(9)20(18,19)15(8-13(16)17)7-10-3-4-10/h2,5-6,10H,3-4,7-8H2,1H3,(H,16,17)