[3-[2-acetamido-4-[(2-methylpropan-2-yl)oxycarbonyloxy]naphthalen-1-yl]-2-oxidanyl-propyl] methanesulfonate

Systemtic Name: [3-[2-acetamido-4-[(2-methylpropan-2-yl)oxycarbonyloxy]naphthalen-1-yl]-2-oxidanyl-propyl] methanesulfonate Openeye Name: [3-(2-acetamido-4-tert-butoxycarbonyloxy-1-naphthyl)-2-hydroxy-propyl] methanesulfonate CAS Name: methanesulfonic acid [3-[2-acetamido-4-[(2-methylpropan-2-yl)oxy-oxomethoxy]-1-naphthalenyl]-2-hydroxypropyl] ester IUPAC Name: [3-[2-acetamido-4-[(2-methylpropan-2-yl)oxycarbonyloxy]naphthalen-1-yl]-2-hydroxypropyl] methanesulfonate Traditional Name: methanesulfonic acid [3-(2-acetamido-4-tert-butoxycarbonyloxy-1-naphthyl)-2-hydroxy-propyl] ester Formula: C21H27NO8S MolecularWeight: 453.50598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=CC=CC=C2C(=C1)OC(=O)OC(C)(C)C)CC(COS(=O)(=O)C)O

Isomeric SMILES

CC(=O)NC1=C(C2=CC=CC=C2C(=C1)OC(=O)OC(C)(C)C)CC(COS(=O)(=O)C)O

InChI

InChI=1S/C21H27NO8S/c1-13(23)22-18-11-19(29-20(25)30-21(2,3)4)16-9-7-6-8-15(16)17(18)10-14(24)12-28-31(5,26)27/h6-9,11,14,24H,10,12H2,1-5H3,(H,22,23)