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5-nitro-2-oxidanyl-3-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-ylmethyl)benzaldehyde
5-nitro-2-oxidanyl-3-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-ylmethyl)benzaldehyde
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Descriptors Computed from Structure
Canonical SMILES:
C1COCCOCCOCCOCCOCCN1CC2=C(C(=CC(=C2)[N+](=O)[O-])C=O)O
Isomeric SMILES
C1COCCOCCOCCOCCOCCN1CC2=C(C(=CC(=C2)[N+](=O)[O-])C=O)O
InChI
InChI=1S/C20H30N2O9/c23-16-18-14-19(22(25)26)13-17(20(18)24)15-21-1-3-27-5-7-29-9-11-31-12-10-30-8-6-28-4-2-21/h13-14,16,24H,1-12,15H2
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