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

Systemtic Name: 5,9-bis(phenoxymethyl)-1-oxa-4,7,10-triazacyclododecane Openeye Name: 5,9-bis(phenoxymethyl)-1-oxa-4,7,10-triazacyclododecane CAS Name: 5,9-bis(phenoxymethyl)-1-oxa-4,7,10-triazacyclododecane IUPAC Name: 5,9-bis(phenoxymethyl)-1-oxa-4,7,10-triazacyclododecane Traditional Name: 5,9-bis(phenoxymethyl)-1-oxa-4,7,10-triazacyclododecane Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCNC(CNCC(N1)COC2=CC=CC=C2)COC3=CC=CC=C3

Isomeric SMILES

C1COCCNC(CNCC(N1)COC2=CC=CC=C2)COC3=CC=CC=C3

InChI

InChI=1S/C22H31N3O3/c1-3-7-21(8-4-1)27-17-19-15-23-16-20(25-12-14-26-13-11-24-19)18-28-22-9-5-2-6-10-22/h1-10,19-20,23-25H,11-18H2