5,9-bis(2-phenylmethoxyethyl)-1-oxa-4,7,10-triazacyclododecane

Systemtic Name: 5,9-bis(2-phenylmethoxyethyl)-1-oxa-4,7,10-triazacyclododecane Openeye Name: 5,9-bis(2-benzyloxyethyl)-1-oxa-4,7,10-triazacyclododecane CAS Name: 5,9-bis(2-phenylmethoxyethyl)-1-oxa-4,7,10-triazacyclododecane IUPAC Name: 5,9-bis(2-phenylmethoxyethyl)-1-oxa-4,7,10-triazacyclododecane Traditional Name: 5,9-bis(2-benzoxyethyl)-1-oxa-4,7,10-triazacyclododecane Formula: C26H39N3O3 MolecularWeight: 441.60616

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCNC(CNCC(N1)CCOCC2=CC=CC=C2)CCOCC3=CC=CC=C3

Isomeric SMILES

C1COCCNC(CNCC(N1)CCOCC2=CC=CC=C2)CCOCC3=CC=CC=C3

InChI

InChI=1S/C26H39N3O3/c1-3-7-23(8-4-1)21-31-15-11-25-19-27-20-26(29-14-18-30-17-13-28-25)12-16-32-22-24-9-5-2-6-10-24/h1-10,25-29H,11-22H2