2-[(4-but-2-ynoxyphenyl)sulfonylamino]ethanoic acid

Systemtic Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]ethanoic acid Openeye Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]acetic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]acetic acid IUPAC Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]acetic acid Traditional Name: 2-[(4-but-2-ynoxyphenyl)sulfonylamino]acetic acid Formula: C12H13NO5S MolecularWeight: 283.30032

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C12H13NO5S/c1-2-3-8-18-10-4-6-11(7-5-10)19(16,17)13-9-12(14)15/h4-7,13H,8-9H2,1H3,(H,14,15)