(3aR,9bS)-6-chloranyl-8-ethyl-1,2,3,3a,4,9b-hexahydropyrrolo[3,4-c]isoquinolin-5-one hydrochloride

Systemtic Name: (3aR,9bS)-6-chloranyl-8-ethyl-1,2,3,3a,4,9b-hexahydropyrrolo[3,4-c]isoquinolin-5-one hydrochloride Openeye Name: (3aR,9bS)-6-chloro-8-ethyl-1,2,3,3a,4,9b-hexahydropyrrolo[3,4-c]isoquinolin-5-one hydrochloride CAS Name: (3aR,9bS)-6-chloro-8-ethyl-1,2,3,3a,4,9b-hexahydropyrrolo[3,4-c]isoquinolin-5-one hydrochloride IUPAC Name: (3aR,9bS)-6-chloro-8-ethyl-1,2,3,3a,4,9b-hexahydropyrrolo[3,4-c]isoquinolin-5-one hydrochloride Traditional Name: (3aR,9bS)-6-chloro-8-ethyl-1,2,3,3a,4,9b-hexahydropyrrol[3,4-c]isoquinolin-5-one hydrochloride Formula: C13H16Cl2N2O MolecularWeight: 287.18494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2C(=C1)C3CNCC3NC2=O)Cl.Cl

Isomeric SMILES

CCC1=CC(=C2C(=C1)[C@H]3CNC[C@@H]3NC2=O)Cl.Cl

InChI

InChI=1S/C13H15ClN2O.ClH/c1-2-7-3-8-9-5-15-6-11(9)16-13(17)12(8)10(14)4-7;/h3-4,9,11,15H,2,5-6H2,1H3,(H,16,17);1H/t9-,11+;/m1./s1