4,10-bis[(4-nitrophenyl)methyl]-1,7-dioxa-4,10-diazacyclododecane

Systemtic Name: 4,10-bis[(4-nitrophenyl)methyl]-1,7-dioxa-4,10-diazacyclododecane Openeye Name: 4,10-bis[(4-nitrophenyl)methyl]-1,7-dioxa-4,10-diazacyclododecane CAS Name: 4,10-bis[(4-nitrophenyl)methyl]-1,7-dioxa-4,10-diazacyclododecane IUPAC Name: 4,10-bis[(4-nitrophenyl)methyl]-1,7-dioxa-4,10-diazacyclododecane Traditional Name: 4,10-bis(4-nitrobenzyl)-1,7-dioxa-4,10-diazacyclododecane Formula: C22H28N4O6 MolecularWeight: 444.48092

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN(CCOCCN1CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN(CCOCCN1CC2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O6/c27-25(28)21-5-1-19(2-6-21)17-23-9-13-31-15-11-24(12-16-32-14-10-23)18-20-3-7-22(8-4-20)26(29)30/h1-8H,9-18H2