(2-methylpropan-2-yl)oxycarbonyl 4-methyl-2-(pyrrolidin-2-ylmethyl)benzenesulfonate

Systemtic Name: (2-methylpropan-2-yl)oxycarbonyl 4-methyl-2-(pyrrolidin-2-ylmethyl)benzenesulfonate Openeye Name: tert-butoxycarbonyl 4-methyl-2-(pyrrolidin-2-ylmethyl)benzenesulfonate CAS Name: 4-methyl-2-(2-pyrrolidinylmethyl)benzenesulfonic acid [(2-methylpropan-2-yl)oxy-oxomethyl] ester IUPAC Name: (2-methylpropan-2-yl)oxycarbonyl 4-methyl-2-(pyrrolidin-2-ylmethyl)benzenesulfonate Traditional Name: 4-methyl-2-(pyrrolidin-2-ylmethyl)benzenesulfonic acid tert-butoxycarbonyl ester Formula: C17H25NO5S MolecularWeight: 355.4491

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)OC(=O)OC(C)(C)C)CC2CCCN2

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)OC(=O)OC(C)(C)C)CC2CCCN2

InChI

InChI=1S/C17H25NO5S/c1-12-7-8-15(13(10-12)11-14-6-5-9-18-14)24(20,21)23-16(19)22-17(2,3)4/h7-8,10,14,18H,5-6,9,11H2,1-4H3