2-[(2R)-5,7-ditert-butyl-2,3-dihydro-1,3-benzoxazol-2-yl]-4-nitro-phenol

Systemtic Name: 2-[(2R)-5,7-ditert-butyl-2,3-dihydro-1,3-benzoxazol-2-yl]-4-nitro-phenol Openeye Name: 2-[(2R)-5,7-ditert-butyl-2,3-dihydro-1,3-benzoxazol-2-yl]-4-nitro-phenol CAS Name: 2-[(2R)-5,7-ditert-butyl-2,3-dihydro-1,3-benzoxazol-2-yl]-4-nitrophenol IUPAC Name: 2-[(2R)-5,7-ditert-butyl-2,3-dihydro-1,3-benzoxazol-2-yl]-4-nitrophenol Traditional Name: 2-[(2R)-5,7-ditert-butyl-2,3-dihydro-1,3-benzoxazol-2-yl]-4-nitro-phenol Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)NC(O2)C3=C(C=CC(=C3)[N+](=O)[O-])O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)N[C@H](O2)C3=C(C=CC(=C3)[N+](=O)[O-])O)C(C)(C)C

InChI

InChI=1S/C21H26N2O4/c1-20(2,3)12-9-15(21(4,5)6)18-16(10-12)22-19(27-18)14-11-13(23(25)26)7-8-17(14)24/h7-11,19,22,24H,1-6H3/t19-/m1/s1