7-chloranyl-2,2-diethyl-1,3,3a,4-tetrahydroisoindol-2-ium

Systemtic Name: 7-chloranyl-2,2-diethyl-1,3,3a,4-tetrahydroisoindol-2-ium Openeye Name: 7-chloro-2,2-diethyl-1,3,3a,4-tetrahydroisoindol-2-ium CAS Name: 7-chloro-2,2-diethyl-1,3,3a,4-tetrahydroisoindol-2-ium IUPAC Name: 7-chloro-2,2-diethyl-1,3,3a,4-tetrahydroisoindol-2-ium Traditional Name: 7-chloro-2,2-diethyl-1,3,3a,4-tetrahydroisoindol-2-ium Formula: C12H19ClN+ MolecularWeight: 212.73896

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CC2CC=CC(=C2C1)Cl)CC

Isomeric SMILES

CC[N+]1(CC2CC=CC(=C2C1)Cl)CC

InChI

InChI=1S/C12H19ClN/c1-3-14(4-2)8-10-6-5-7-12(13)11(10)9-14/h5,7,10H,3-4,6,8-9H2,1-2H3/q+1