(6S)-6-(2-morpholin-4-ium-4-ylethyl)-7-oxidanylidene-5H-thieno[2,3-b]pyrrolizine-6-carbonitrile

Systemtic Name: (6S)-6-(2-morpholin-4-ium-4-ylethyl)-7-oxidanylidene-5H-thieno[2,3-b]pyrrolizine-6-carbonitrile Openeye Name: (6S)-6-(2-morpholin-4-ium-4-ylethyl)-7-oxo-5H-thieno[2,3-b]pyrrolizine-6-carbonitrile CAS Name: (6S)-6-[2-(4-morpholin-4-iumyl)ethyl]-7-oxo-5H-thieno[2,3-b]pyrrolizine-6-carbonitrile IUPAC Name: (6S)-6-(2-morpholin-4-ium-4-ylethyl)-7-oxo-5H-thieno[2,3-b]pyrrolizine-6-carbonitrile Traditional Name: (6S)-7-keto-6-(2-morpholin-4-ium-4-ylethyl)-5H-thieno[2,3-b]pyrrolizine-6-carbonitrile Formula: C16H18N3O2S+ MolecularWeight: 316.39802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC2(CN3C4=C(C=C3C2=O)SC=C4)C#N

Isomeric SMILES

C1COCC[NH+]1CC[C@]2(CN3C4=C(C=C3C2=O)SC=C4)C#N

InChI

InChI=1S/C16H17N3O2S/c17-10-16(2-3-18-4-6-21-7-5-18)11-19-12-1-8-22-14(12)9-13(19)15(16)20/h1,8-9H,2-7,11H2/p+1/t16-/m1/s1