methyl 4-(piperazin-1-ylsulfonylmethyl)benzoate

Systemtic Name: methyl 4-(piperazin-1-ylsulfonylmethyl)benzoate Openeye Name: methyl 4-(piperazin-1-ylsulfonylmethyl)benzoate CAS Name: 4-(1-piperazinylsulfonylmethyl)benzoic acid methyl ester IUPAC Name: methyl 4-(piperazin-1-ylsulfonylmethyl)benzoate Traditional Name: 4-(piperazinosulfonylmethyl)benzoic acid methyl ester Formula: C13H18N2O4S MolecularWeight: 298.35802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)N2CCNCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)N2CCNCC2

InChI

InChI=1S/C13H18N2O4S/c1-19-13(16)12-4-2-11(3-5-12)10-20(17,18)15-8-6-14-7-9-15/h2-5,14H,6-10H2,1H3