1-(4-methylphenyl)sulfonyl-4-[(2-methylpropan-2-yl)oxycarbonyl]piperazine-2-carboxylic acid

Systemtic Name: 1-(4-methylphenyl)sulfonyl-4-[(2-methylpropan-2-yl)oxycarbonyl]piperazine-2-carboxylic acid Openeye Name: 4-tert-butoxycarbonyl-1-(p-tolylsulfonyl)piperazine-2-carboxylic acid CAS Name: 1-(4-methylphenyl)sulfonyl-4-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-piperazinecarboxylic acid IUPAC Name: 1-(4-methylphenyl)sulfonyl-4-[(2-methylpropan-2-yl)oxycarbonyl]piperazine-2-carboxylic acid Traditional Name: 4-tert-butoxycarbonyl-1-tosyl-piperazine-2-carboxylic acid Formula: C17H24N2O6S MolecularWeight: 384.44726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H24N2O6S/c1-12-5-7-13(8-6-12)26(23,24)19-10-9-18(11-14(19)15(20)21)16(22)25-17(2,3)4/h5-8,14H,9-11H2,1-4H3,(H,20,21)