[(4E)-2,2,5,9-tetramethyldeca-4,8-dienyl] 4-nitrobenzoate

Systemtic Name: [(4E)-2,2,5,9-tetramethyldeca-4,8-dienyl] 4-nitrobenzoate Openeye Name: [(4E)-2,2,5,9-tetramethyldeca-4,8-dienyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(4E)-2,2,5,9-tetramethyldeca-4,8-dienyl] ester IUPAC Name: [(4E)-2,2,5,9-tetramethyldeca-4,8-dienyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(4E)-2,2,5,9-tetramethyldeca-4,8-dienyl] ester Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO4/c1-16(2)7-6-8-17(3)13-14-21(4,5)15-26-20(23)18-9-11-19(12-10-18)22(24)25/h7,9-13H,6,8,14-15H2,1-5H3/b17-13+