2-[[4-[3-(2,5-dimethylphenoxy)propanoylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[3-(2,5-dimethylphenoxy)propanoylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[3-(2,5-dimethylphenoxy)propanoylamino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[3-(2,5-dimethylphenoxy)-1-oxopropyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[3-(2,5-dimethylphenoxy)propanoylamino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[3-(2,5-dimethylphenoxy)propanoylamino]phenyl]sulfonylamino]acetic acid Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C19H22N2O6S/c1-13-3-4-14(2)17(11-13)27-10-9-18(22)21-15-5-7-16(8-6-15)28(25,26)20-12-19(23)24/h3-8,11,20H,9-10,12H2,1-2H3,(H,21,22)(H,23,24)