2,6-ditert-butyl-3-[(4-nitrophenyl)methyl]phenol

Systemtic Name: 2,6-ditert-butyl-3-[(4-nitrophenyl)methyl]phenol Openeye Name: 2,6-ditert-butyl-3-[(4-nitrophenyl)methyl]phenol CAS Name: 2,6-ditert-butyl-3-[(4-nitrophenyl)methyl]phenol IUPAC Name: 2,6-ditert-butyl-3-[(4-nitrophenyl)methyl]phenol Traditional Name: 2,6-ditert-butyl-3-(4-nitrobenzyl)phenol Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(C=C1)CC2=CC=C(C=C2)[N+](=O)[O-])C(C)(C)C)O

Isomeric SMILES

CC(C)(C)C1=C(C(=C(C=C1)CC2=CC=C(C=C2)[N+](=O)[O-])C(C)(C)C)O

InChI

InChI=1S/C21H27NO3/c1-20(2,3)17-12-9-15(18(19(17)23)21(4,5)6)13-14-7-10-16(11-8-14)22(24)25/h7-12,23H,13H2,1-6H3