N-(pyridin-3-ylmethyl)-1-[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methanamine

Systemtic Name: N-(pyridin-3-ylmethyl)-1-[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methanamine Openeye Name: N-(3-pyridylmethyl)-1-[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methanamine CAS Name: N-(3-pyridinylmethyl)-1-[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methanamine IUPAC Name: N-(pyridin-3-ylmethyl)-1-[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methanamine Traditional Name: 3-pyridylmethyl-[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)benzyl]amine Formula: C24H38N6 MolecularWeight: 410.59872

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CNCC3=CN=CC=C3

Isomeric SMILES

C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CNCC3=CN=CC=C3

InChI

InChI=1S/C24H38N6/c1-4-24(19-28-9-1)20-29-18-22-5-7-23(8-6-22)21-30-16-3-12-26-14-13-25-10-2-11-27-15-17-30/h1,4-9,19,25-27,29H,2-3,10-18,20-21H2