(3-methanoyl-5-nitro-4-oxidanyl-phenyl)methyl decanoate

Systemtic Name: (3-methanoyl-5-nitro-4-oxidanyl-phenyl)methyl decanoate Openeye Name: (3-formyl-4-hydroxy-5-nitro-phenyl)methyl decanoate CAS Name: decanoic acid (3-formyl-4-hydroxy-5-nitrophenyl)methyl ester IUPAC Name: (3-formyl-4-hydroxy-5-nitrophenyl)methyl decanoate Traditional Name: capric acid (3-formyl-4-hydroxy-5-nitro-benzyl) ester Formula: C18H25NO6 MolecularWeight: 351.3942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)OCC1=CC(=C(C(=C1)C=O)O)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCC(=O)OCC1=CC(=C(C(=C1)C=O)O)[N+](=O)[O-]

InChI

InChI=1S/C18H25NO6/c1-2-3-4-5-6-7-8-9-17(21)25-13-14-10-15(12-20)18(22)16(11-14)19(23)24/h10-12,22H,2-9,13H2,1H3