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

Systemtic Name: 1-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate Openeye Name: 1-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate CAS Name: 1-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate IUPAC Name: 1-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate Traditional Name: 1-methyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium thiocyanate Formula: C27H22N2S MolecularWeight: 406.54198

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C5=CC=CC=C5.C(#N)[S-]

Isomeric SMILES

C[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C5=CC=CC=C5.C(#N)[S-]

InChI

InChI=1S/C26H22N.CHNS/c1-27-25(21-13-6-3-7-14-21)18-24(19-10-4-2-5-11-19)23-17-16-20-12-8-9-15-22(20)26(23)27;2-1-3/h2-15,18H,16-17H2,1H3;3H/q+1;/p-1