ethyl 4-(3-methylsulfonylpropanoylamino)benzoate

Systemtic Name: ethyl 4-(3-methylsulfonylpropanoylamino)benzoate Openeye Name: ethyl 4-(3-methylsulfonylpropanoylamino)benzoate CAS Name: 4-[(3-methylsulfonyl-1-oxopropyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(3-methylsulfonylpropanoylamino)benzoate Traditional Name: 4-(3-mesylpropanoylamino)benzoic acid ethyl ester Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C

InChI

InChI=1S/C13H17NO5S/c1-3-19-13(16)10-4-6-11(7-5-10)14-12(15)8-9-20(2,17)18/h4-7H,3,8-9H2,1-2H3,(H,14,15)