(11bS)-3-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-1,6,7,11b-tetrahydropyrazino[2,1-a]isoquinolin-4-one

Systemtic Name: (11bS)-3-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-1,6,7,11b-tetrahydropyrazino[2,1-a]isoquinolin-4-one Openeye Name: (11bS)-3-[2-(4-chlorophenyl)-2-oxo-ethyl]-1,6,7,11b-tetrahydropyrazino[2,1-a]isoquinolin-4-one CAS Name: (11bS)-3-[2-(4-chlorophenyl)-2-oxoethyl]-1,6,7,11b-tetrahydropyrazino[2,1-a]isoquinolin-4-one IUPAC Name: (11bS)-3-[2-(4-chlorophenyl)-2-oxoethyl]-1,6,7,11b-tetrahydropyrazino[2,1-a]isoquinolin-4-one Traditional Name: (11bS)-3-[2-(4-chlorophenyl)-2-keto-ethyl]-1,6,7,11b-tetrahydropyrazin[2,1-a]isoquinolin-4-one Formula: C20H17ClN2O2 MolecularWeight: 352.81418

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(CN=C(C2=O)CC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C41

Isomeric SMILES

C1CN2[C@H](CN=C(C2=O)CC(=O)C3=CC=C(C=C3)Cl)C4=CC=CC=C41

InChI

InChI=1S/C20H17ClN2O2/c21-15-7-5-14(6-8-15)19(24)11-17-20(25)23-10-9-13-3-1-2-4-16(13)18(23)12-22-17/h1-8,18H,9-12H2/t18-/m1/s1