[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-methoxy-5-sulfamoyl-benzoate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 2-methoxy-5-sulfamoyl-benzoate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 2-methoxy-5-sulfamoyl-benzoate CAS Name: 2-methoxy-5-sulfamoylbenzoic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 2-methoxy-5-sulfamoylbenzoate Traditional Name: 2-methoxy-5-sulfamoyl-benzoic acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H18N2O6S MolecularWeight: 342.36752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)OC

Isomeric SMILES

CC(C(=O)NCC=C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)N)OC

InChI

InChI=1S/C14H18N2O6S/c1-4-7-16-13(17)9(2)22-14(18)11-8-10(23(15,19)20)5-6-12(11)21-3/h4-6,8-9H,1,7H2,2-3H3,(H,16,17)(H2,15,19,20)