ethyl 3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoate

Systemtic Name: ethyl 3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoate Openeye Name: ethyl 3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoate CAS Name: 3-[(3-hydroxyphenyl)sulfonylamino]-5-hexynoic acid ethyl ester IUPAC Name: ethyl 3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoate Traditional Name: 3-[(3-hydroxyphenyl)sulfonylamino]hex-5-ynoic acid ethyl ester Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC#C)NS(=O)(=O)C1=CC=CC(=C1)O

Isomeric SMILES

CCOC(=O)CC(CC#C)NS(=O)(=O)C1=CC=CC(=C1)O

InChI

InChI=1S/C14H17NO5S/c1-3-6-11(9-14(17)20-4-2)15-21(18,19)13-8-5-7-12(16)10-13/h1,5,7-8,10-11,15-16H,4,6,9H2,2H3