3,4,5,6-tetrakis[4-(dimethylamino)pyridin-1-ium-1-yl]benzene-1,2-diamine

Systemtic Name: 3,4,5,6-tetrakis[4-(dimethylamino)pyridin-1-ium-1-yl]benzene-1,2-diamine Openeye Name: 3,4,5,6-tetrakis[4-(dimethylamino)pyridin-1-ium-1-yl]benzene-1,2-diamine CAS Name: 3,4,5,6-tetrakis[4-(dimethylamino)-1-pyridin-1-iumyl]benzene-1,2-diamine IUPAC Name: 3,4,5,6-tetrakis[4-(dimethylamino)pyridin-1-ium-1-yl]benzene-1,2-diamine Traditional Name: [1-[2,3-diamino-4,5,6-tris[4-(dimethylamino)pyridin-1-ium-1-yl]phenyl]pyridin-1-ium-4-yl]-dimethyl-amine Formula: C34H44N10+4 MolecularWeight: 592.78016

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)C2=C(C(=C(C(=C2[N+]3=CC=C(C=C3)N(C)C)[N+]4=CC=C(C=C4)N(C)C)[N+]5=CC=C(C=C5)N(C)C)N)N

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)C2=C(C(=C(C(=C2[N+]3=CC=C(C=C3)N(C)C)[N+]4=CC=C(C=C4)N(C)C)[N+]5=CC=C(C=C5)N(C)C)N)N

InChI

InChI=1S/C34H44N10/c1-37(2)25-9-17-41(18-10-25)31-29(35)30(36)32(42-19-11-26(12-20-42)38(3)4)34(44-23-15-28(16-24-44)40(7)8)33(31)43-21-13-27(14-22-43)39(5)6/h9-24H,35-36H2,1-8H3/q+4