3-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-(naphthalen-2-ylsulfonylamino)-3-phenoxy-pentanoic acid

Systemtic Name: 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-(naphthalen-2-ylsulfonylamino)-3-phenoxy-pentanoic acid Openeye Name: 2-tert-butoxycarbonyl-3-methyl-2-(2-naphthylsulfonylamino)-3-phenoxy-pentanoic acid CAS Name: 3-methyl-2-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-(2-naphthalenylsulfonylamino)-3-phenoxypentanoic acid IUPAC Name: 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonyl]-2-(naphthalen-2-ylsulfonylamino)-3-phenoxypentanoic acid Traditional Name: 2-tert-butoxycarbonyl-3-methyl-2-(2-naphthylsulfonylamino)-3-phenoxy-valeric acid Formula: C27H31NO7S MolecularWeight: 513.60254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(C(=O)O)(C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1)OC3=CC=CC=C3

Isomeric SMILES

CCC(C)(C(C(=O)O)(C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1)OC3=CC=CC=C3

InChI

InChI=1S/C27H31NO7S/c1-6-26(5,34-21-14-8-7-9-15-21)27(23(29)30,24(31)35-25(2,3)4)28-36(32,33)22-17-16-19-12-10-11-13-20(19)18-22/h7-18,28H,6H2,1-5H3,(H,29,30)