methyl 4-[phenylsulfonyl(piperazin-1-yl)methyl]benzoate

Systemtic Name: methyl 4-[phenylsulfonyl(piperazin-1-yl)methyl]benzoate Openeye Name: methyl 4-[benzenesulfonyl(piperazin-1-yl)methyl]benzoate CAS Name: 4-[benzenesulfonyl(1-piperazinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[benzenesulfonyl(piperazin-1-yl)methyl]benzoate Traditional Name: 4-[besyl(piperazino)methyl]benzoic acid methyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(N2CCNCC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(N2CCNCC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O4S/c1-25-19(22)16-9-7-15(8-10-16)18(21-13-11-20-12-14-21)26(23,24)17-5-3-2-4-6-17/h2-10,18,20H,11-14H2,1H3