methyl 2-piperazin-1-ylsulfonylbenzoate hydrochloride

Systemtic Name: methyl 2-piperazin-1-ylsulfonylbenzoate hydrochloride Openeye Name: methyl 2-piperazin-1-ylsulfonylbenzoate hydrochloride CAS Name: 2-(1-piperazinylsulfonyl)benzoic acid methyl ester hydrochloride IUPAC Name: methyl 2-piperazin-1-ylsulfonylbenzoate hydrochloride Traditional Name: 2-piperazinosulfonylbenzoic acid methyl ester hydrochloride Formula: C12H17ClN2O4S MolecularWeight: 320.79238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCNCC2.Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCNCC2.Cl

InChI

InChI=1S/C12H16N2O4S.ClH/c1-18-12(15)10-4-2-3-5-11(10)19(16,17)14-8-6-13-7-9-14;/h2-5,13H,6-9H2,1H3;1H