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N-(phenylmethyl)-N'-(pyren-1-ylmethyl)octane-1,8-diamine

N-(phenylmethyl)-N'-(pyren-1-ylmethyl)octane-1,8-diamine

Systemtic Name:N-(phenylmethyl)-N'-(pyren-1-ylmethyl)octane-1,8-diamine
Openeye Name:N-benzyl-N'-(pyren-1-ylmethyl)octane-1,8-diamine
CAS Name:N-(phenylmethyl)-N'-(1-pyrenylmethyl)octane-1,8-diamine
IUPAC Name:N-benzyl-N'-(pyren-1-ylmethyl)octane-1,8-diamine
Traditional Name:benzyl-[8-(pyren-1-ylmethylamino)octyl]amine
Formula: C32H36N2
MolecularWeight: 448.64164
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCCCCCCCNCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2


Isomeric SMILES

C1=CC=C(C=C1)CNCCCCCCCCNCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2


InChI

InChI=1S/C32H36N2/c1(3-8-21-33-23-25-11-6-5-7-12-25)2-4-9-22-34-24-29-18-17-28-16-15-26-13-10-14-27-19-20-30(29)32(28)31(26)27/h5-7,10-20,33-34H,1-4,8-9,21-24H2


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