2-[cyclopropylmethyl-(4-methylphenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[cyclopropylmethyl-(4-methylphenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-[cyclopropylmethyl(p-tolylsulfonyl)amino]acetic acid CAS Name: 2-[cyclopropylmethyl-(4-methylphenyl)sulfonylamino]acetic acid IUPAC Name: 2-[cyclopropylmethyl-(4-methylphenyl)sulfonylamino]acetic acid Traditional Name: 2-[cyclopropylmethyl(tosyl)amino]acetic acid Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO4S/c1-10-2-6-12(7-3-10)19(17,18)14(9-13(15)16)8-11-4-5-11/h2-3,6-7,11H,4-5,8-9H2,1H3,(H,15,16)