(3aR,9bS)-6-chloranyl-8-ethyl-4-(phenylmethyl)-2,3,3a,9b-tetrahydro-1H-pyrrolo[3,4-c]isoquinolin-5-one

Systemtic Name: (3aR,9bS)-6-chloranyl-8-ethyl-4-(phenylmethyl)-2,3,3a,9b-tetrahydro-1H-pyrrolo[3,4-c]isoquinolin-5-one Openeye Name: (3aR,9bS)-4-benzyl-6-chloro-8-ethyl-2,3,3a,9b-tetrahydro-1H-pyrrolo[3,4-c]isoquinolin-5-one CAS Name: (3aR,9bS)-6-chloro-8-ethyl-4-(phenylmethyl)-2,3,3a,9b-tetrahydro-1H-pyrrolo[3,4-c]isoquinolin-5-one IUPAC Name: (3aR,9bS)-4-benzyl-6-chloro-8-ethyl-2,3,3a,9b-tetrahydro-1H-pyrrolo[3,4-c]isoquinolin-5-one Traditional Name: (3aR,9bS)-4-benzyl-6-chloro-8-ethyl-2,3,3a,9b-tetrahydro-1H-pyrrol[3,4-c]isoquinolin-5-one Formula: C20H21ClN2O MolecularWeight: 340.84654

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2C(=C1)C3CNCC3N(C2=O)CC4=CC=CC=C4)Cl

Isomeric SMILES

CCC1=CC(=C2C(=C1)[C@H]3CNC[C@@H]3N(C2=O)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C20H21ClN2O/c1-2-13-8-15-16-10-22-11-18(16)23(12-14-6-4-3-5-7-14)20(24)19(15)17(21)9-13/h3-9,16,18,22H,2,10-12H2,1H3/t16-,18+/m1/s1