N,N'-bis(anthracen-9-ylmethyl)propane-1,3-diamine

Systemtic Name: N,N'-bis(anthracen-9-ylmethyl)propane-1,3-diamine Openeye Name: N,N'-bis(9-anthrylmethyl)propane-1,3-diamine CAS Name: N,N'-bis(9-anthracenylmethyl)propane-1,3-diamine IUPAC Name: N,N'-bis(anthracen-9-ylmethyl)propane-1,3-diamine Traditional Name: 9-anthrylmethyl-[3-(9-anthrylmethylamino)propyl]amine Formula: C33H30N2 MolecularWeight: 454.6047

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CNCCCNCC4=C5C=CC=CC5=CC6=CC=CC=C64

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CNCCCNCC4=C5C=CC=CC5=CC6=CC=CC=C64

InChI

InChI=1S/C33H30N2/c1-5-14-28-24(10-1)20-25-11-2-6-15-29(25)32(28)22-34-18-9-19-35-23-33-30-16-7-3-12-26(30)21-27-13-4-8-17-31(27)33/h1-8,10-17,20-21,34-35H,9,18-19,22-23H2