ethyl 4-[[2-(4-chlorophenyl)piperazin-1-yl]sulfonylmethyl]oxane-4-carboxylate

Systemtic Name: ethyl 4-[[2-(4-chlorophenyl)piperazin-1-yl]sulfonylmethyl]oxane-4-carboxylate Openeye Name: ethyl 4-[[2-(4-chlorophenyl)piperazin-1-yl]sulfonylmethyl]tetrahydropyran-4-carboxylate CAS Name: 4-[[2-(4-chlorophenyl)-1-piperazinyl]sulfonylmethyl]-4-oxanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-chlorophenyl)piperazin-1-yl]sulfonylmethyl]oxane-4-carboxylate Traditional Name: 4-[[2-(4-chlorophenyl)piperazino]sulfonylmethyl]tetrahydropyran-4-carboxylic acid ethyl ester Formula: C19H27ClN2O5S MolecularWeight: 430.94608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCOCC1)CS(=O)(=O)N2CCNCC2C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1(CCOCC1)CS(=O)(=O)N2CCNCC2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H27ClN2O5S/c1-2-27-18(23)19(7-11-26-12-8-19)14-28(24,25)22-10-9-21-13-17(22)15-3-5-16(20)6-4-15/h3-6,17,21H,2,7-14H2,1H3