(2S,5R)-2-tert-butyl-5-(5-methyl-2-nitro-phenyl)-5-phenyl-1,3-dioxolan-4-one

Systemtic Name: (2S,5R)-2-tert-butyl-5-(5-methyl-2-nitro-phenyl)-5-phenyl-1,3-dioxolan-4-one Openeye Name: (2S,5R)-2-tert-butyl-5-(5-methyl-2-nitro-phenyl)-5-phenyl-1,3-dioxolan-4-one CAS Name: (2S,5R)-2-tert-butyl-5-(5-methyl-2-nitrophenyl)-5-phenyl-1,3-dioxolan-4-one IUPAC Name: (2S,5R)-2-tert-butyl-5-(5-methyl-2-nitrophenyl)-5-phenyl-1,3-dioxolan-4-one Traditional Name: (2S,5R)-2-tert-butyl-5-(5-methyl-2-nitro-phenyl)-5-phenyl-1,3-dioxolan-4-one Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])C2(C(=O)OC(O2)C(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])[C@@]2(C(=O)O[C@H](O2)C(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO5/c1-13-10-11-16(21(23)24)15(12-13)20(14-8-6-5-7-9-14)17(22)25-18(26-20)19(2,3)4/h5-12,18H,1-4H3/t18-,20-/m1/s1