4-oxidanylidene-2-thiophen-2-yl-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-2-ium-2-carbaldehyde

Systemtic Name: 4-oxidanylidene-2-thiophen-2-yl-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-2-ium-2-carbaldehyde Openeye Name: 4-oxo-2-(2-thienyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-2-ium-2-carbaldehyde CAS Name: 4-oxo-2-thiophen-2-yl-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-2-ium-2-carboxaldehyde IUPAC Name: 4-oxo-2-thiophen-2-yl-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-2-ium-2-carbaldehyde Traditional Name: 4-keto-2-(2-thienyl)-3,6,7,11b-tetrahydro-1H-pyrazin[2,1-a]isoquinolin-2-ium-2-carbaldehyde Formula: C17H17N2O2S+ MolecularWeight: 313.39408

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(C[N+](CC2=O)(C=O)C3=CC=CS3)C4=CC=CC=C41

Isomeric SMILES

C1CN2C(C[N+](CC2=O)(C=O)C3=CC=CS3)C4=CC=CC=C41

InChI

InChI=1S/C17H17N2O2S/c20-12-19(17-6-3-9-22-17)10-15-14-5-2-1-4-13(14)7-8-18(15)16(21)11-19/h1-6,9,12,15H,7-8,10-11H2/q+1