ethyl 2-(2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)ethanoate

Systemtic Name: ethyl 2-(2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)ethanoate Openeye Name: ethyl 2-(2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)acetate CAS Name: 2-(2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)acetate Traditional Name: 2-(2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium-1-yl)acetic acid ethyl ester Formula: C29H26NO2+ MolecularWeight: 420.52224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26NO2/c1-2-32-28(31)20-30-27(23-14-7-4-8-15-23)19-26(21-11-5-3-6-12-21)25-18-17-22-13-9-10-16-24(22)29(25)30/h3-16,19H,2,17-18,20H2,1H3/q+1