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

Systemtic Name: 4-oxidanylidene-2-thiophen-2-yl-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-3-carbaldehyde Openeye Name: 4-oxo-2-(2-thienyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-3-carbaldehyde CAS Name: 4-oxo-2-thiophen-2-yl-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-3-carboxaldehyde IUPAC Name: 4-oxo-2-thiophen-2-yl-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinoline-3-carbaldehyde Traditional Name: 4-keto-2-(2-thienyl)-3,6,7,11b-tetrahydro-1H-pyrazin[2,1-a]isoquinoline-3-carbaldehyde Formula: C17H16N2O2S MolecularWeight: 312.38614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2C(CN(C(C2=O)C=O)C3=CC=CS3)C4=CC=CC=C41

Isomeric SMILES

C1CN2C(CN(C(C2=O)C=O)C3=CC=CS3)C4=CC=CC=C41

InChI

InChI=1S/C17H16N2O2S/c20-11-15-17(21)18-8-7-12-4-1-2-5-13(12)14(18)10-19(15)16-6-3-9-22-16/h1-6,9,11,14-15H,7-8,10H2