1-phenethyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate

Systemtic Name: 1-phenethyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate Openeye Name: 1-phenethyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate CAS Name: 1-phenethyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate IUPAC Name: 1-phenethyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate Traditional Name: 1-phenethyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate Formula: C34H28N2S MolecularWeight: 496.66452

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)[N+](=C(C=C2C4=CC=CC=C4)C5=CC=CC=C5)CCC6=CC=CC=C6.C(#N)[S-]

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)[N+](=C(C=C2C4=CC=CC=C4)C5=CC=CC=C5)CCC6=CC=CC=C6.C(#N)[S-]

InChI

InChI=1S/C33H28N.CHNS/c1-4-12-25(13-5-1)22-23-34-32(28-17-8-3-9-18-28)24-31(26-14-6-2-7-15-26)30-21-20-27-16-10-11-19-29(27)33(30)34;2-1-3/h1-19,24H,20-23H2;3H/q+1;/p-1