(4-cyano-4,4-diphenyl-butyl)-(diphenylmethyl)azanium chloride

Systemtic Name: (4-cyano-4,4-diphenyl-butyl)-(diphenylmethyl)azanium chloride Openeye Name: benzhydryl-(4-cyano-4,4-diphenyl-butyl)ammonium chloride CAS Name: (4-cyano-4,4-diphenylbutyl)-(diphenylmethyl)ammonium chloride IUPAC Name: benzhydryl-(4-cyano-4,4-diphenylbutyl)azanium chloride Traditional Name: benzhydryl-(4-cyano-4,4-diphenyl-butyl)ammonium chloride Formula: C30H29ClN2 MolecularWeight: 453.01766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)[NH2+]CCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C30H28N2.ClH/c31-24-30(27-18-9-3-10-19-27,28-20-11-4-12-21-28)22-13-23-32-29(25-14-5-1-6-15-25)26-16-7-2-8-17-26;/h1-12,14-21,29,32H,13,22-23H2;1H