7-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hept-4-ynoic acid

Systemtic Name: 7-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hept-4-ynoic acid Openeye Name: 7-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hept-4-ynoic acid CAS Name: 7-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-4-heptynoic acid IUPAC Name: 7-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hept-4-ynoic acid Traditional Name: 7-(2-methoxyethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hept-4-ynoic acid Formula: C23H27NO7S MolecularWeight: 461.52798

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCCC#CCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC

Isomeric SMILES

COCCOCCC#CCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C23H27NO7S/c1-29-16-17-31-15-5-3-4-6-22(23(25)26)24-32(27,28)21-13-9-19(10-14-21)18-7-11-20(30-2)12-8-18/h7-14,22,24H,5-6,15-17H2,1-2H3,(H,25,26)