4-chloranyl-2,2-diethyl-1,3-dihydrobenzo[f]isoindol-2-ium

Systemtic Name: 4-chloranyl-2,2-diethyl-1,3-dihydrobenzo[f]isoindol-2-ium Openeye Name: 4-chloro-2,2-diethyl-1,3-dihydrobenzo[f]isoindol-2-ium CAS Name: 4-chloro-2,2-diethyl-1,3-dihydrobenzo[f]isoindol-2-ium IUPAC Name: 4-chloro-2,2-diethyl-1,3-dihydrobenzo[f]isoindol-2-ium Traditional Name: 4-chloro-2,2-diethyl-1,3-dihydrobenz[f]isoindol-2-ium Formula: C16H19ClN+ MolecularWeight: 260.78176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CC2=CC3=CC=CC=C3C(=C2C1)Cl)CC

Isomeric SMILES

CC[N+]1(CC2=CC3=CC=CC=C3C(=C2C1)Cl)CC

InChI

InChI=1S/C16H19ClN/c1-3-18(4-2)10-13-9-12-7-5-6-8-14(12)16(17)15(13)11-18/h5-9H,3-4,10-11H2,1-2H3/q+1