2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-3-(2,4,5-trimethylphenyl)propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-3-(2,4,5-trimethylphenyl)propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-hydroxy-3-(2,4,5-trimethylphenyl)propanoic acid CAS Name: 3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(2,4,5-trimethylphenyl)propanoic acid IUPAC Name: 3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2,4,5-trimethylphenyl)propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-hydroxy-3-(2,4,5-trimethylphenyl)propionic acid Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)C(C(C(=O)O)NC(=O)OC(C)(C)C)O)C

Isomeric SMILES

CC1=CC(=C(C=C1C)C(C(C(=O)O)NC(=O)OC(C)(C)C)O)C

InChI

InChI=1S/C17H25NO5/c1-9-7-11(3)12(8-10(9)2)14(19)13(15(20)21)18-16(22)23-17(4,5)6/h7-8,13-14,19H,1-6H3,(H,18,22)(H,20,21)