N,N-didodecylpyren-1-amine

Systemtic Name: N,N-didodecylpyren-1-amine Openeye Name: N,N-didodecylpyren-1-amine CAS Name: N,N-didodecyl-1-pyrenamine IUPAC Name: N,N-didodecylpyren-1-amine Traditional Name: dilauryl(pyren-1-yl)amine Formula: C40H59N MolecularWeight: 553.90316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(CCCCCCCCCCCC)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

Isomeric SMILES

CCCCCCCCCCCCN(CCCCCCCCCCCC)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C40H59N/c1-3-5-7-9-11-13-15-17-19-21-32-41(33-22-20-18-16-14-12-10-8-6-4-2)38-31-29-36-27-26-34-24-23-25-35-28-30-37(38)40(36)39(34)35/h23-31H,3-22,32-33H2,1-2H3