tert-butyl 4-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]sulfonyloxane-4-carboxylate

Systemtic Name: tert-butyl 4-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]sulfonyloxane-4-carboxylate Openeye Name: tert-butyl 4-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]sulfonyltetrahydropyran-4-carboxylate CAS Name: 4-[[4-[4-(2-methoxyethoxy)phenyl]-1-piperazinyl]sulfonyl]-4-oxanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[4-(2-methoxyethoxy)phenyl]piperazin-1-yl]sulfonyloxane-4-carboxylate Traditional Name: 4-[4-[4-(2-methoxyethoxy)phenyl]piperazino]sulfonyltetrahydropyran-4-carboxylic acid tert-butyl ester Formula: C23H36N2O7S MolecularWeight: 484.60614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CCOCC1)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OCCOC

Isomeric SMILES

CC(C)(C)OC(=O)C1(CCOCC1)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)OCCOC

InChI

InChI=1S/C23H36N2O7S/c1-22(2,3)32-21(26)23(9-15-30-16-10-23)33(27,28)25-13-11-24(12-14-25)19-5-7-20(8-6-19)31-18-17-29-4/h5-8H,9-18H2,1-4H3