4,6-ditert-butyl-2-methyl-2-[(4-nitrophenoxy)methyl]-3H-1-benzofuran-5-ol

Systemtic Name: 4,6-ditert-butyl-2-methyl-2-[(4-nitrophenoxy)methyl]-3H-1-benzofuran-5-ol Openeye Name: 4,6-ditert-butyl-2-methyl-2-[(4-nitrophenoxy)methyl]-3H-benzofuran-5-ol CAS Name: 4,6-ditert-butyl-2-methyl-2-[(4-nitrophenoxy)methyl]-3H-benzofuran-5-ol IUPAC Name: 4,6-ditert-butyl-2-methyl-2-[(4-nitrophenoxy)methyl]-3H-1-benzofuran-5-ol Traditional Name: 4,6-ditert-butyl-2-methyl-2-[(4-nitrophenoxy)methyl]coumaran-5-ol Formula: C24H31NO5 MolecularWeight: 413.50664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C=C(C(=C2C(C)(C)C)O)C(C)(C)C)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1(CC2=C(O1)C=C(C(=C2C(C)(C)C)O)C(C)(C)C)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H31NO5/c1-22(2,3)18-12-19-17(20(21(18)26)23(4,5)6)13-24(7,30-19)14-29-16-10-8-15(9-11-16)25(27)28/h8-12,26H,13-14H2,1-7H3