2-(1,4,7,10,13,16-hexaoxacyclooctadec-2-ylmethoxy)-4,6-dinitro-phenol

Systemtic Name: 2-(1,4,7,10,13,16-hexaoxacyclooctadec-2-ylmethoxy)-4,6-dinitro-phenol Openeye Name: 2-(1,4,7,10,13,16-hexaoxacyclooctadec-2-ylmethoxy)-4,6-dinitro-phenol CAS Name: 2-(1,4,7,10,13,16-hexaoxacyclooctadec-2-ylmethoxy)-4,6-dinitrophenol IUPAC Name: 2-(1,4,7,10,13,16-hexaoxacyclooctadec-2-ylmethoxy)-4,6-dinitrophenol Traditional Name: 2-(1,4,7,10,13,16-hexaoxacyclooctadec-2-ylmethoxy)-4,6-dinitro-phenol Formula: C19H28N2O12 MolecularWeight: 476.43182

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCCOC(COCCOCCO1)COC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1COCCOCCOC(COCCOCCO1)COC2=CC(=CC(=C2O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H28N2O12/c22-19-17(21(25)26)11-15(20(23)24)12-18(19)33-14-16-13-31-8-7-29-4-3-27-1-2-28-5-6-30-9-10-32-16/h11-12,16,22H,1-10,13-14H2