N-(1-cyanocycloheptyl)-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(1-cyanocycloheptyl)-2-[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(1-cyanocycloheptyl)-2-[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C18H26N3OS+ MolecularWeight: 332.48354

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)NC(=O)C[NH+]2CCCC2C3=CC=CS3

Isomeric SMILES

C1CCCC(CC1)(C#N)NC(=O)C[NH+]2CCC[C@H]2C3=CC=CS3

InChI

InChI=1S/C18H25N3OS/c19-14-18(9-3-1-2-4-10-18)20-17(22)13-21-11-5-7-15(21)16-8-6-12-23-16/h6,8,12,15H,1-5,7,9-11,13H2,(H,20,22)/p+1/t15-/m0/s1