4-(2-sulfamoylphenyl)but-3-yn-2-yl ethanoate

Systemtic Name: 4-(2-sulfamoylphenyl)but-3-yn-2-yl ethanoate Openeye Name: [1-methyl-3-(2-sulfamoylphenyl)prop-2-ynyl] acetate CAS Name: acetic acid 4-(2-sulfamoylphenyl)but-3-yn-2-yl ester IUPAC Name: 4-(2-sulfamoylphenyl)but-3-yn-2-yl acetate Traditional Name: acetic acid [1-methyl-3-(2-sulfamoylphenyl)prop-2-ynyl] ester Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC=CC=C1S(=O)(=O)N)OC(=O)C

Isomeric SMILES

CC(C#CC1=CC=CC=C1S(=O)(=O)N)OC(=O)C

InChI

InChI=1S/C12H13NO4S/c1-9(17-10(2)14)7-8-11-5-3-4-6-12(11)18(13,15)16/h3-6,9H,1-2H3,(H2,13,15,16)