4-(2-nitrobutyl)-2,6-bis(2,4,4-trimethylpentan-2-yl)phenol

Systemtic Name: 4-(2-nitrobutyl)-2,6-bis(2,4,4-trimethylpentan-2-yl)phenol Openeye Name: 4-(2-nitrobutyl)-2,6-bis(1,1,3,3-tetramethylbutyl)phenol CAS Name: 4-(2-nitrobutyl)-2,6-bis(2,4,4-trimethylpentan-2-yl)phenol IUPAC Name: 4-(2-nitrobutyl)-2,6-bis(2,4,4-trimethylpentan-2-yl)phenol Traditional Name: 4-(2-nitrobutyl)-2,6-bis(1,1,3,3-tetramethylbutyl)phenol Formula: C26H45NO3 MolecularWeight: 419.6404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC(=C(C(=C1)C(C)(C)CC(C)(C)C)O)C(C)(C)CC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCC(CC1=CC(=C(C(=C1)C(C)(C)CC(C)(C)C)O)C(C)(C)CC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C26H45NO3/c1-12-19(27(29)30)13-18-14-20(25(8,9)16-23(2,3)4)22(28)21(15-18)26(10,11)17-24(5,6)7/h14-15,19,28H,12-13,16-17H2,1-11H3