2-tert-butyl-1-heptyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium

Systemtic Name: 2-tert-butyl-1-heptyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium Openeye Name: 2-tert-butyl-1-heptyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium CAS Name: 2-tert-butyl-1-heptyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium IUPAC Name: 2-tert-butyl-1-heptyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium Traditional Name: 2-tert-butyl-1-heptyl-4-phenyl-5,6-dihydrobenzo[h]quinolin-1-ium Formula: C30H38N+ MolecularWeight: 412.62942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

CCCCCCC[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C(C)(C)C

InChI

InChI=1S/C30H38N/c1-5-6-7-8-14-21-31-28(30(2,3)4)22-27(23-15-10-9-11-16-23)26-20-19-24-17-12-13-18-25(24)29(26)31/h9-13,15-18,22H,5-8,14,19-21H2,1-4H3/q+1