[3-(4-propan-2-ylpiperazin-1-yl)cyclobutyl] 4-methylbenzenesulfonate

Systemtic Name: [3-(4-propan-2-ylpiperazin-1-yl)cyclobutyl] 4-methylbenzenesulfonate Openeye Name: [3-(4-isopropylpiperazin-1-yl)cyclobutyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [3-(4-propan-2-yl-1-piperazinyl)cyclobutyl] ester IUPAC Name: [3-(4-propan-2-ylpiperazin-1-yl)cyclobutyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [3-(4-isopropylpiperazino)cyclobutyl] ester Formula: C18H28N2O3S MolecularWeight: 352.49152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(C2)N3CCN(CC3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(C2)N3CCN(CC3)C(C)C

InChI

InChI=1S/C18H28N2O3S/c1-14(2)19-8-10-20(11-9-19)16-12-17(13-16)23-24(21,22)18-6-4-15(3)5-7-18/h4-7,14,16-17H,8-13H2,1-3H3