ethyl 5-azanyl-4-cyano-3-(piperidin-1-ium-1-ylmethyl)thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-(piperidin-1-ium-1-ylmethyl)thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-(piperidin-1-ium-1-ylmethyl)thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-(1-piperidin-1-iumylmethyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-(piperidin-1-ium-1-ylmethyl)thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-(piperidin-1-ium-1-ylmethyl)thiophene-2-carboxylic acid ethyl ester Formula: C14H20N3O2S+ MolecularWeight: 294.3925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)C[NH+]2CCCCC2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)C[NH+]2CCCCC2

InChI

InChI=1S/C14H19N3O2S/c1-2-19-14(18)12-11(10(8-15)13(16)20-12)9-17-6-4-3-5-7-17/h2-7,9,16H2,1H3/p+1