2-ethyl-1-(2,4,6-triphenylphenyl)isoquinolin-2-ium

Systemtic Name: 2-ethyl-1-(2,4,6-triphenylphenyl)isoquinolin-2-ium Openeye Name: 2-ethyl-1-(2,4,6-triphenylphenyl)isoquinolin-2-ium CAS Name: 2-ethyl-1-(2,4,6-triphenylphenyl)isoquinolin-2-ium IUPAC Name: 2-ethyl-1-(2,4,6-triphenylphenyl)isoquinolin-2-ium Traditional Name: 2-ethyl-1-(2,4,6-triphenylphenyl)isoquinolin-2-ium Formula: C35H28N+ MolecularWeight: 462.60352

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(C2=CC=CC=C2C=C1)C3=C(C=C(C=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC[N+]1=C(C2=CC=CC=C2C=C1)C3=C(C=C(C=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H28N/c1-2-36-23-22-29-20-12-13-21-31(29)35(36)34-32(27-16-8-4-9-17-27)24-30(26-14-6-3-7-15-26)25-33(34)28-18-10-5-11-19-28/h3-25H,2H2,1H3/q+1