[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(4-methoxyphenyl)sulfonylamino]benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(4-methoxyphenyl)sulfonylamino]benzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(4-methoxyphenyl)sulfonylamino]benzoate CAS Name: 2-[(4-methoxyphenyl)sulfonylamino]benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(4-methoxyphenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-methoxyphenyl)sulfonylamino]benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OCC(=O)NCC#C

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OCC(=O)NCC#C

InChI

InChI=1S/C19H18N2O6S/c1-3-12-20-18(22)13-27-19(23)16-6-4-5-7-17(16)21-28(24,25)15-10-8-14(26-2)9-11-15/h1,4-11,21H,12-13H2,2H3,(H,20,22)