dodecyl 3-nitro-4-oxidanyl-benzoate

Systemtic Name: dodecyl 3-nitro-4-oxidanyl-benzoate Openeye Name: dodecyl 4-hydroxy-3-nitro-benzoate CAS Name: 4-hydroxy-3-nitrobenzoic acid dodecyl ester IUPAC Name: dodecyl 4-hydroxy-3-nitrobenzoate Traditional Name: 4-hydroxy-3-nitro-benzoic acid lauryl ester Formula: C19H29NO5 MolecularWeight: 351.43726

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29NO5/c1-2-3-4-5-6-7-8-9-10-11-14-25-19(22)16-12-13-18(21)17(15-16)20(23)24/h12-13,15,21H,2-11,14H2,1H3