3-(azepan-1-ium-1-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanamide

Systemtic Name: 3-(azepan-1-ium-1-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanamide Openeye Name: 3-(azepan-1-ium-1-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanamide CAS Name: 3-(1-azepan-1-iumyl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanamide IUPAC Name: 3-(azepan-1-ium-1-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propanamide Traditional Name: 3-(azepan-1-ium-1-yl)-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)propionamide Formula: C19H28N3OS+ MolecularWeight: 346.51012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)CCC(=O)NC2=C(C3=C(S2)CCCCC3)C#N

Isomeric SMILES

C1CCC[NH+](CC1)CCC(=O)NC2=C(C3=C(S2)CCCCC3)C#N

InChI

InChI=1S/C19H27N3OS/c20-14-16-15-8-4-3-5-9-17(15)24-19(16)21-18(23)10-13-22-11-6-1-2-7-12-22/h1-13H2,(H,21,23)/p+1