[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 3-(methylsulfonylamino)benzoate

Systemtic Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl] 3-(methylsulfonylamino)benzoate Openeye Name: [2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl] 3-(methanesulfonamido)benzoate CAS Name: 3-(methanesulfonamido)benzoic acid [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl] 3-(methanesulfonamido)benzoate Traditional Name: 3-(methanesulfonamido)benzoic acid [2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl] ester Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)COC(=O)C1=CC(=CC=C1)NS(=O)(=O)C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)COC(=O)C1=CC(=CC=C1)NS(=O)(=O)C

InChI

InChI=1S/C17H22N2O5S/c1-5-17(6-2,7-3)18-15(20)12-24-16(21)13-9-8-10-14(11-13)19-25(4,22)23/h1,8-11,19H,6-7,12H2,2-4H3,(H,18,20)