(2S)-2-(2,5-ditert-butyl-4-oxidanyl-phenoxy)carbonyloxy-2-(2-nitrophenyl)ethanoic acid

Systemtic Name: (2S)-2-(2,5-ditert-butyl-4-oxidanyl-phenoxy)carbonyloxy-2-(2-nitrophenyl)ethanoic acid Openeye Name: (2S)-2-(2,5-ditert-butyl-4-hydroxy-phenoxy)carbonyloxy-2-(2-nitrophenyl)acetic acid CAS Name: (2S)-2-[(2,5-ditert-butyl-4-hydroxyphenoxy)-oxomethoxy]-2-(2-nitrophenyl)acetic acid IUPAC Name: (2S)-2-(2,5-ditert-butyl-4-hydroxyphenoxy)carbonyloxy-2-(2-nitrophenyl)acetic acid Traditional Name: (2S)-2-(2,5-ditert-butyl-4-hydroxy-phenoxy)carbonyloxy-2-(2-nitrophenyl)acetic acid Formula: C23H27NO8 MolecularWeight: 445.46238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1OC(=O)OC(C2=CC=CC=C2[N+](=O)[O-])C(=O)O)C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1OC(=O)O[C@@H](C2=CC=CC=C2[N+](=O)[O-])C(=O)O)C(C)(C)C)O

InChI

InChI=1S/C23H27NO8/c1-22(2,3)14-12-18(15(11-17(14)25)23(4,5)6)31-21(28)32-19(20(26)27)13-9-7-8-10-16(13)24(29)30/h7-12,19,25H,1-6H3,(H,26,27)/t19-/m0/s1