(5S,6R)-5,6-diphenyl-1,4,7,10-tetrazacyclotridecane

Systemtic Name: (5S,6R)-5,6-diphenyl-1,4,7,10-tetrazacyclotridecane Openeye Name: (5S,6R)-5,6-diphenyl-1,4,7,10-tetrazacyclotridecane CAS Name: (5S,6R)-5,6-diphenyl-1,4,7,10-tetrazacyclotridecane IUPAC Name: (5S,6R)-5,6-diphenyl-1,4,7,10-tetrazacyclotridecane Traditional Name: (5S,6R)-5,6-diphenyl-1,4,7,10-tetrazacyclotridecane Formula: C21H30N4 MolecularWeight: 338.4897

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNC(C(NCCNC1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CNCCN[C@H]([C@H](NCCNC1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H30N4/c1-3-8-18(9-4-1)20-21(19-10-5-2-6-11-19)25-17-15-23-13-7-12-22-14-16-24-20/h1-6,8-11,20-25H,7,12-17H2/t20-,21+