5-(2-sulfamoylphenyl)pent-4-ynyl 2,2-dimethylpropanoate

Systemtic Name: 5-(2-sulfamoylphenyl)pent-4-ynyl 2,2-dimethylpropanoate Openeye Name: 5-(2-sulfamoylphenyl)pent-4-ynyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 5-(2-sulfamoylphenyl)pent-4-ynyl ester IUPAC Name: 5-(2-sulfamoylphenyl)pent-4-ynyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 5-(2-sulfamoylphenyl)pent-4-ynyl ester Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO4S/c1-16(2,3)15(18)21-12-8-4-5-9-13-10-6-7-11-14(13)22(17,19)20/h6-7,10-11H,4,8,12H2,1-3H3,(H2,17,19,20)