[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 3-(2-phenylethenylsulfonylamino)benzoate

Systemtic Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl] 3-(2-phenylethenylsulfonylamino)benzoate Openeye Name: [2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl] 3-(styrylsulfonylamino)benzoate CAS Name: 3-(2-phenylethenylsulfonylamino)benzoic acid [2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 3-(2-phenylethenylsulfonylamino)benzoate Traditional Name: 3-(styrylsulfonylamino)benzoic acid [2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl] ester Formula: C21H19N3O6S MolecularWeight: 441.45706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)COC(=O)C2=CC(=CC=C2)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)COC(=O)C2=CC(=CC=C2)NS(=O)(=O)C=CC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O6S/c1-15-12-19(23-30-15)22-20(25)14-29-21(26)17-8-5-9-18(13-17)24-31(27,28)11-10-16-6-3-2-4-7-16/h2-13,24H,14H2,1H3,(H,22,23,25)