(phenylmethyl) 1-(4-chloranylsulfonylphenyl)piperazine-2-carboxylate

Systemtic Name: (phenylmethyl) 1-(4-chloranylsulfonylphenyl)piperazine-2-carboxylate Openeye Name: benzyl 1-(4-chlorosulfonylphenyl)piperazine-2-carboxylate CAS Name: 1-(4-chlorosulfonylphenyl)-2-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(4-chlorosulfonylphenyl)piperazine-2-carboxylate Traditional Name: 1-(4-chlorosulfonylphenyl)piperazine-2-carboxylic acid benzyl ester Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C(=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)Cl

Isomeric SMILES

C1CN(C(CN1)C(=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)Cl

InChI

InChI=1S/C18H19ClN2O4S/c19-26(23,24)16-8-6-15(7-9-16)21-11-10-20-12-17(21)18(22)25-13-14-4-2-1-3-5-14/h1-9,17,20H,10-13H2