tert-butyl 3-[1-[(2-methylpropan-2-yl)oxycarbonyl-(3-methylsulfonyloxypropyl)amino]ethyl]benzoate

Systemtic Name: tert-butyl 3-[1-[(2-methylpropan-2-yl)oxycarbonyl-(3-methylsulfonyloxypropyl)amino]ethyl]benzoate Openeye Name: tert-butyl 3-[1-[tert-butoxycarbonyl(3-methylsulfonyloxypropyl)amino]ethyl]benzoate CAS Name: 3-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(3-methylsulfonyloxypropyl)amino]ethyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[1-[(2-methylpropan-2-yl)oxycarbonyl-(3-methylsulfonyloxypropyl)amino]ethyl]benzoate Traditional Name: 3-[1-[tert-butoxycarbonyl(3-methylsulfonyloxypropyl)amino]ethyl]benzoic acid tert-butyl ester Formula: C22H35NO7S MolecularWeight: 457.5808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)OC(C)(C)C)N(CCCOS(=O)(=O)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)OC(C)(C)C)N(CCCOS(=O)(=O)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H35NO7S/c1-16(17-11-9-12-18(15-17)19(24)29-21(2,3)4)23(20(25)30-22(5,6)7)13-10-14-28-31(8,26)27/h9,11-12,15-16H,10,13-14H2,1-8H3