N,N'-bis[(2,7-dimethoxynaphthalen-1-yl)methyl]hexane-1,6-diamine; methanesulfonic acid

Systemtic Name: N,N'-bis[(2,7-dimethoxynaphthalen-1-yl)methyl]hexane-1,6-diamine; methanesulfonic acid Openeye Name: N,N'-bis[(2,7-dimethoxy-1-naphthyl)methyl]hexane-1,6-diamine; methanesulfonic acid CAS Name: N,N'-bis[(2,7-dimethoxy-1-naphthalenyl)methyl]hexane-1,6-diamine; methanesulfonic acid IUPAC Name: N,N'-bis[(2,7-dimethoxynaphthalen-1-yl)methyl]hexane-1,6-diamine; methanesulfonic acid Traditional Name: (2,7-dimethoxy-1-naphthyl)methyl-[6-[(2,7-dimethoxy-1-naphthyl)methylamino]hexyl]amine; mesylic acid Formula: C33H44N2O7S MolecularWeight: 612.77666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2CNCCCCCCNCC3=C(C=CC4=C3C=C(C=C4)OC)OC)OC.CS(=O)(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2CNCCCCCCNCC3=C(C=CC4=C3C=C(C=C4)OC)OC)OC.CS(=O)(=O)O

InChI

InChI=1S/C32H40N2O4.CH4O3S/c1-35-25-13-9-23-11-15-31(37-3)29(27(23)19-25)21-33-17-7-5-6-8-18-34-22-30-28-20-26(36-2)14-10-24(28)12-16-32(30)38-4;1-5(2,3)4/h9-16,19-20,33-34H,5-8,17-18,21-22H2,1-4H3;1H3,(H,2,3,4)