(4aS,8R,8aR)-2-diazonio-5-methyl-8-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalen-1-olate

Systemtic Name: (4aS,8R,8aR)-2-diazonio-5-methyl-8-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalen-1-olate Openeye Name: (4aS,8R,8aR)-2-diazonio-8-isopropyl-5-methyl-3,4,4a,7,8,8a-hexahydronaphthalen-1-olate CAS Name: (4aS,8R,8aR)-2-diazonio-5-methyl-8-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalen-1-olate IUPAC Name: (4aS,8R,8aR)-2-diazonio-5-methyl-8-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalen-1-olate Traditional Name: (4aS,8R,8aR)-2-diazonio-8-isopropyl-5-methyl-3,4,4a,7,8,8a-hexahydronaphthalen-1-olate Formula: C14H20N2O MolecularWeight: 232.3214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C2C1CCC(=C2[O-])[N+]#N)C(C)C

Isomeric SMILES

CC1=CC[C@@H]([C@@H]2[C@@H]1CCC(=C2[O-])[N+]#N)C(C)C

InChI

InChI=1S/C14H20N2O/c1-8(2)10-5-4-9(3)11-6-7-12(16-15)14(17)13(10)11/h4,8,10-11,13H,5-7H2,1-3H3/t10-,11-,13-/m1/s1