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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(C=C2)CNCCCCCCNCC3=C(C4=C(C=C3)C=C(C=C4)OC)OC)OC.CS(=O)(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(C=C2)CNCCCCCCNCC3=C(C4=C(C=C3)C=C(C=C4)OC)OC)OC.CS(=O)(=O)O

InChI

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