propyl 4-(3-methylsulfonylpropanoylamino)benzoate

Systemtic Name: propyl 4-(3-methylsulfonylpropanoylamino)benzoate Openeye Name: propyl 4-(3-methylsulfonylpropanoylamino)benzoate CAS Name: 4-[(3-methylsulfonyl-1-oxopropyl)amino]benzoic acid propyl ester IUPAC Name: propyl 4-(3-methylsulfonylpropanoylamino)benzoate Traditional Name: 4-(3-mesylpropanoylamino)benzoic acid propyl ester Formula: C14H19NO5S MolecularWeight: 313.36936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO5S/c1-3-9-20-14(17)11-4-6-12(7-5-11)15-13(16)8-10-21(2,18)19/h4-7H,3,8-10H2,1-2H3,(H,15,16)