7,10,14,17-tetrakis(phenylmethyl)-1,4-dioxa-7,10,14,17-tetrazacyclononadecan-12-ol

Systemtic Name: 7,10,14,17-tetrakis(phenylmethyl)-1,4-dioxa-7,10,14,17-tetrazacyclononadecan-12-ol Openeye Name: 7,10,14,17-tetrabenzyl-1,4-dioxa-7,10,14,17-tetrazacyclononadecan-12-ol CAS Name: 7,10,14,17-tetrakis(phenylmethyl)-1,4-dioxa-7,10,14,17-tetrazacyclononadecan-12-ol IUPAC Name: 7,10,14,17-tetrabenzyl-1,4-dioxa-7,10,14,17-tetrazacyclononadecan-12-ol Traditional Name: 7,10,14,17-tetrabenzyl-1,4-dioxa-7,10,14,17-tetrazacyclononadecan-12-ol Formula: C41H54N4O3 MolecularWeight: 650.89246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(CN(CCN(CCOCCOCCN1CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=CC=C4)O)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CC(CN(CCN(CCOCCOCCN1CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CC=CC=C4)O)CC5=CC=CC=C5

InChI

InChI=1S/C41H54N4O3/c46-41-35-44(33-39-17-9-3-10-18-39)23-21-42(31-37-13-5-1-6-14-37)25-27-47-29-30-48-28-26-43(32-38-15-7-2-8-16-38)22-24-45(36-41)34-40-19-11-4-12-20-40/h1-20,41,46H,21-36H2