N-(phenylmethyl)-N'-(pyren-1-ylmethyl)pentane-1,5-diamine

Systemtic Name: N-(phenylmethyl)-N'-(pyren-1-ylmethyl)pentane-1,5-diamine Openeye Name: N-benzyl-N'-(pyren-1-ylmethyl)pentane-1,5-diamine CAS Name: N-(phenylmethyl)-N'-(1-pyrenylmethyl)pentane-1,5-diamine IUPAC Name: N-benzyl-N'-(pyren-1-ylmethyl)pentane-1,5-diamine Traditional Name: benzyl-[5-(pyren-1-ylmethylamino)pentyl]amine Formula: C29H30N2 MolecularWeight: 406.5619

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCCCCCNCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

Isomeric SMILES

C1=CC=C(C=C1)CNCCCCCNCC2=C3C=CC4=CC=CC5=C4C3=C(C=C5)C=C2

InChI

InChI=1S/C29H30N2/c1-3-8-22(9-4-1)20-30-18-5-2-6-19-31-21-26-15-14-25-13-12-23-10-7-11-24-16-17-27(26)29(25)28(23)24/h1,3-4,7-17,30-31H,2,5-6,18-21H2