N'-[4-[4-(pyren-1-ylmethylamino)butylamino]butyl]butane-1,4-diamine

Systemtic Name: N'-[4-[4-(pyren-1-ylmethylamino)butylamino]butyl]butane-1,4-diamine Openeye Name: N'-[4-[4-(pyren-1-ylmethylamino)butylamino]butyl]butane-1,4-diamine CAS Name: N'-[4-[4-(1-pyrenylmethylamino)butylamino]butyl]butane-1,4-diamine IUPAC Name: N'-[4-[4-(pyren-1-ylmethylamino)butylamino]butyl]butane-1,4-diamine Traditional Name: 4-aminobutyl-[4-[4-(pyren-1-ylmethylamino)butylamino]butyl]amine Formula: C29H40N4 MolecularWeight: 444.6547

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CNCCCCNCCCCNCCCCN

Isomeric SMILES

C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CNCCCCNCCCCNCCCCN

InChI

InChI=1S/C29H40N4/c30-16-1-2-17-31-18-3-4-19-32-20-5-6-21-33-22-26-13-12-25-11-10-23-8-7-9-24-14-15-27(26)29(25)28(23)24/h7-15,31-33H,1-6,16-22,30H2