N1,N3-bis(1-azanylbutyl)-5-phenylmethoxy-nonane-1,3-diamine

Systemtic Name: N1,N3-bis(1-azanylbutyl)-5-phenylmethoxy-nonane-1,3-diamine Openeye Name: N1,N3-bis(1-aminobutyl)-5-benzyloxy-nonane-1,3-diamine CAS Name: N1,N3-bis(1-aminobutyl)-5-phenylmethoxynonane-1,3-diamine IUPAC Name: 1-N,3-N-bis(1-aminobutyl)-5-phenylmethoxynonane-1,3-diamine Traditional Name: 1-aminobutyl-[3-(1-aminobutylamino)-5-benzoxy-nonyl]amine Formula: C24H46N4O MolecularWeight: 406.64824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(CCNC(CCC)N)NC(CCC)N)OCC1=CC=CC=C1

Isomeric SMILES

CCCCC(CC(CCNC(CCC)N)NC(CCC)N)OCC1=CC=CC=C1

InChI

InChI=1S/C24H46N4O/c1-4-7-15-22(29-19-20-13-9-8-10-14-20)18-21(28-24(26)12-6-3)16-17-27-23(25)11-5-2/h8-10,13-14,21-24,27-28H,4-7,11-12,15-19,25-26H2,1-3H3