10-[(4-nitrophenyl)methyl]-1,4,7-trioxa-10-azoniacyclododecane

Systemtic Name: 10-[(4-nitrophenyl)methyl]-1,4,7-trioxa-10-azoniacyclododecane Openeye Name: 10-[(4-nitrophenyl)methyl]-1,4,7-trioxa-10-azoniacyclododecane CAS Name: 10-[(4-nitrophenyl)methyl]-1,4,7-trioxa-10-azoniacyclododecane IUPAC Name: 10-[(4-nitrophenyl)methyl]-1,4,7-trioxa-10-azoniacyclododecane Traditional Name: 10-(4-nitrobenzyl)-1,4,7-trioxa-10-azoniacyclododecane Formula: C15H23N2O5+ MolecularWeight: 311.35352

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCOCCOCC[NH+]1CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1COCCOCCOCC[NH+]1CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H22N2O5/c18-17(19)15-3-1-14(2-4-15)13-16-5-7-20-9-11-22-12-10-21-8-6-16/h1-4H,5-13H2/p+1