(E)-[azanyl-(2-dimethylaminoethylamino)methylidene]-[[3-[[azanyl-(2-dimethylaminoethylamino)methylidene]azaniumylmethyl]phenyl]methyl]azanium; tetraphenylboranuide

Systemtic Name: (E)-[azanyl-(2-dimethylaminoethylamino)methylidene]-[[3-[[azanyl-(2-dimethylaminoethylamino)methylidene]azaniumylmethyl]phenyl]methyl]azanium; tetraphenylboranuide Openeye Name: (E)-[amino-(2-dimethylaminoethylamino)methylene]-[[3-[[amino-(2-dimethylaminoethylamino)methylene]ammoniomethyl]phenyl]methyl]ammonium; tetraphenylboranuide CAS Name: (E)-[amino-(2-dimethylaminoethylamino)methylidene]-[[3-[[amino-(2-dimethylaminoethylamino)methylidene]ammoniomethyl]phenyl]methyl]ammonium; tetraphenylboranuide IUPAC Name: (E)-[amino-(2-dimethylaminoethylamino)methylidene]-[[3-[[amino-(2-dimethylaminoethylamino)methylidene]azaniumylmethyl]phenyl]methyl]azanium; tetraphenylboranuide Traditional Name: (E)-[amino-(2-dimethylaminoethylamino)methylene]-[3-[[amino-(2-dimethylaminoethylamino)methylene]ammoniomethyl]benzyl]ammonium; tetraphenylboranuide Formula: C66H76B2N8 MolecularWeight: 1002.98524

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CN(C)CCNC(=[NH+]CC1=CC(=CC=C1)C[NH+]=C(N)NCCN(C)C)N

Isomeric SMILES

[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[B-](C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.CN(C)CCN/C(=[NH+]/CC1=CC(=CC=C1)C/[NH+]=C(\N)/NCCN(C)C)/N

InChI

InChI=1S/2C24H20B.C18H34N8/c2*1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-25(2)10-8-21-17(19)23-13-15-6-5-7-16(12-15)14-24-18(20)22-9-11-26(3)4/h2*1-20H;5-7,12H,8-11,13-14H2,1-4H3,(H3,19,21,23)(H3,20,22,24)/q2*-1;/p+2