N-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]naphthalen-1-amine

Systemtic Name: N-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]naphthalen-1-amine Openeye Name: N-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]naphthalen-1-amine CAS Name: N-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]-1-naphthalenamine IUPAC Name: N-[[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)phenyl]methyl]naphthalen-1-amine Traditional Name: 1-naphthyl-[4-(1,4,8,11-tetrazacyclotetradec-1-ylmethyl)benzyl]amine Formula: C28H39N5 MolecularWeight: 445.64276

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CNC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CNCCNCCCN(CCNC1)CC2=CC=C(C=C2)CNC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H39N5/c1-2-8-27-26(6-1)7-3-9-28(27)32-22-24-10-12-25(13-11-24)23-33-20-5-16-30-18-17-29-14-4-15-31-19-21-33/h1-3,6-13,29-32H,4-5,14-23H2