6-(2-methoxyethoxymethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hex-4-ynoic acid

Systemtic Name: 6-(2-methoxyethoxymethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hex-4-ynoic acid Openeye Name: 6-(2-methoxyethoxymethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hex-4-ynoic acid CAS Name: 6-(2-methoxyethoxymethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]-4-hexynoic acid IUPAC Name: 6-(2-methoxyethoxymethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hex-4-ynoic acid Traditional Name: 6-(2-methoxyethoxymethoxy)-2-[[4-(4-methoxyphenyl)phenyl]sulfonylamino]hex-4-ynoic acid Formula: C23H27NO8S MolecularWeight: 477.52738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27NO8S/c1-29-15-16-32-17-31-14-4-3-5-22(23(25)26)24-33(27,28)21-12-8-19(9-13-21)18-6-10-20(30-2)11-7-18/h6-13,22,24H,5,14-17H2,1-2H3,(H,25,26)