2,9-bis(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)-1,10-phenanthroline

Systemtic Name: 2,9-bis(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)-1,10-phenanthroline Openeye Name: 2,9-bis(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)-1,10-phenanthroline CAS Name: 2,9-bis(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)-1,10-phenanthroline IUPAC Name: 2,9-bis(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)-1,10-phenanthroline Traditional Name: 2,9-bis(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)-1,10-phenanthroline Formula: C34H56N10 MolecularWeight: 604.87544

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCCCN(CCNC1)CC2=NC3=C(C=CC4=C3N=C(C=C4)CN5CCCNCCNCCCNCC5)C=C2

Isomeric SMILES

C1CNCCNCCCN(CCNC1)CC2=NC3=C(C=CC4=C3N=C(C=C4)CN5CCCNCCNCCCNCC5)C=C2

InChI

InChI=1S/C34H56N10/c1-11-35-17-19-37-15-3-23-43(25-21-39-13-1)27-31-9-7-29-5-6-30-8-10-32(42-34(30)33(29)41-31)28-44-24-4-16-38-20-18-36-12-2-14-40-22-26-44/h5-10,35-40H,1-4,11-28H2