(3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-2-ium

Systemtic Name: (3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-2-ium Openeye Name: (3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-2-ium CAS Name: (3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-2-ium IUPAC Name: (3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-2-ium Traditional Name: (3aS,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-2-ium Formula: C8H16N+ MolecularWeight: 126.21934

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C[NH2+]CC2C1

Isomeric SMILES

C1CC[C@@H]2C[NH2+]C[C@H]2C1

InChI

InChI=1S/C8H15N/c1-2-4-8-6-9-5-7(8)3-1/h7-9H,1-6H2/p+1/t7-,8-/m1/s1