2,2,5,5-tetramethylhexyl 2,4-dimethyl-4-nitro-pentanoate

Systemtic Name: 2,2,5,5-tetramethylhexyl 2,4-dimethyl-4-nitro-pentanoate Openeye Name: 2,2,5,5-tetramethylhexyl 2,4-dimethyl-4-nitro-pentanoate CAS Name: 2,4-dimethyl-4-nitropentanoic acid 2,2,5,5-tetramethylhexyl ester IUPAC Name: 2,2,5,5-tetramethylhexyl 2,4-dimethyl-4-nitropentanoate Traditional Name: 2,4-dimethyl-4-nitro-valeric acid 2,2,5,5-tetramethylhexyl ester Formula: C17H33NO4 MolecularWeight: 315.44822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H33NO4/c1-13(11-17(7,8)18(20)21)14(19)22-12-16(5,6)10-9-15(2,3)4/h13H,9-12H2,1-8H3