1,4,8,11-tetrazacyclotetradecane; 3-(1,4,8,11-tetrazacyclotetradec-1-yl)propan-1-amine

Systemtic Name: 1,4,8,11-tetrazacyclotetradecane; 3-(1,4,8,11-tetrazacyclotetradec-1-yl)propan-1-amine Openeye Name: 1,4,8,11-tetrazacyclotetradecane; 3-(1,4,8,11-tetrazacyclotetradec-1-yl)propan-1-amine CAS Name: 1,4,8,11-tetrazacyclotetradecane; 3-(1,4,8,11-tetrazacyclotetradec-1-yl)-1-propanamine IUPAC Name: 1,4,8,11-tetrazacyclotetradecane; 3-(1,4,8,11-tetrazacyclotetradec-1-yl)propan-1-amine Traditional Name: 1,4,8,11-tetrazacyclotetradecane; 3-(1,4,8,11-tetrazacyclotetradec-1-yl)propylamine Formula: C23H55N9 MolecularWeight: 457.7431

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCCCNCCNC1.C1CNCCNCCCN(CCNC1)CCCN

Isomeric SMILES

C1CNCCNCCCNCCNC1.C1CNCCNCCCN(CCNC1)CCCN

InChI

InChI=1S/C13H31N5.C10H24N4/c14-4-1-11-18-12-3-7-16-9-8-15-5-2-6-17-10-13-18;1-3-11-7-9-13-5-2-6-14-10-8-12-4-1/h15-17H,1-14H2;11-14H,1-10H2