N-(1-cyanocycloheptyl)-2-(4-phenethylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(1-cyanocycloheptyl)-2-(4-phenethylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(1-cyanocycloheptyl)-2-(4-phenethylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(1-cyanocycloheptyl)-2-(4-phenethyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(1-cyanocycloheptyl)-2-(4-phenethylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(1-cyanocycloheptyl)-2-(4-phenethylpiperazin-1-ium-1-yl)acetamide Formula: C22H33N4O+ MolecularWeight: 369.52362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C#N)NC(=O)C[NH+]2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

C1CCCC(CC1)(C#N)NC(=O)C[NH+]2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C22H32N4O/c23-19-22(11-6-1-2-7-12-22)24-21(27)18-26-16-14-25(15-17-26)13-10-20-8-4-3-5-9-20/h3-5,8-9H,1-2,6-7,10-18H2,(H,24,27)/p+1