anthracen-9-ylmethyl-(4-cyano-4,4-diphenyl-butyl)-methyl-azanium chloride

Systemtic Name: anthracen-9-ylmethyl-(4-cyano-4,4-diphenyl-butyl)-methyl-azanium chloride Openeye Name: 9-anthrylmethyl-(4-cyano-4,4-diphenyl-butyl)-methyl-ammonium chloride CAS Name: 9-anthracenylmethyl-(4-cyano-4,4-diphenylbutyl)-methylammonium chloride IUPAC Name: anthracen-9-ylmethyl-(4-cyano-4,4-diphenylbutyl)-methylazanium chloride Traditional Name: 9-anthrylmethyl-(4-cyano-4,4-diphenyl-butyl)-methyl-ammonium chloride Formula: C33H31ClN2 MolecularWeight: 491.06564

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)CC3=C4C=CC=CC4=CC5=CC=CC=C53.[Cl-]

Isomeric SMILES

C[NH+](CCCC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2)CC3=C4C=CC=CC4=CC5=CC=CC=C53.[Cl-]

InChI

InChI=1S/C33H30N2.ClH/c1-35(24-32-30-19-10-8-13-26(30)23-27-14-9-11-20-31(27)32)22-12-21-33(25-34,28-15-4-2-5-16-28)29-17-6-3-7-18-29;/h2-11,13-20,23H,12,21-22,24H2,1H3;1H