4-[2-methyl-1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyloxy]propan-2-yl]sulfonyl-3-phenyl-butanoic acid

Systemtic Name: 4-[2-methyl-1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoyloxy]propan-2-yl]sulfonyl-3-phenyl-butanoic acid Openeye Name: 4-[2-[2-(tert-butoxycarbonylamino)acetyl]oxy-1,1-dimethyl-ethyl]sulfonyl-3-phenyl-butanoic acid CAS Name: 4-[2-methyl-1-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethoxy]propan-2-yl]sulfonyl-3-phenylbutanoic acid IUPAC Name: 4-[2-methyl-1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]oxypropan-2-yl]sulfonyl-3-phenylbutanoic acid Traditional Name: 4-[2-[2-(tert-butoxycarbonylamino)acetyl]oxy-1,1-dimethyl-ethyl]sulfonyl-3-phenyl-butyric acid Formula: C21H31NO8S MolecularWeight: 457.53774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)OCC(C)(C)S(=O)(=O)CC(CC(=O)O)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)OCC(C)(C)S(=O)(=O)CC(CC(=O)O)C1=CC=CC=C1

InChI

InChI=1S/C21H31NO8S/c1-20(2,3)30-19(26)22-12-18(25)29-14-21(4,5)31(27,28)13-16(11-17(23)24)15-9-7-6-8-10-15/h6-10,16H,11-14H2,1-5H3,(H,22,26)(H,23,24)