methyl 4-(3-methylsulfonylpropanoylamino)benzoate

Systemtic Name: methyl 4-(3-methylsulfonylpropanoylamino)benzoate Openeye Name: methyl 4-(3-methylsulfonylpropanoylamino)benzoate CAS Name: 4-[(3-methylsulfonyl-1-oxopropyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-(3-methylsulfonylpropanoylamino)benzoate Traditional Name: 4-(3-mesylpropanoylamino)benzoic acid methyl ester Formula: C12H15NO5S MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO5S/c1-18-12(15)9-3-5-10(6-4-9)13-11(14)7-8-19(2,16)17/h3-6H,7-8H2,1-2H3,(H,13,14)