N-(1-cyanocyclohexyl)-N-methyl-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-N-methyl-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(1-cyanocyclohexyl)-N-methyl-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(1-cyanocyclohexyl)-N-methyl-2-[(2S)-2-phenyl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(1-cyanocyclohexyl)-N-methyl-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(1-cyanocyclohexyl)-N-methyl-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide Formula: C20H28N3O+ MolecularWeight: 326.45582

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C[NH+]1CCCC1C2=CC=CC=C2)C3(CCCCC3)C#N

Isomeric SMILES

CN(C(=O)C[NH+]1CCC[C@H]1C2=CC=CC=C2)C3(CCCCC3)C#N

InChI

InChI=1S/C20H27N3O/c1-22(20(16-21)12-6-3-7-13-20)19(24)15-23-14-8-11-18(23)17-9-4-2-5-10-17/h2,4-5,9-10,18H,3,6-8,11-15H2,1H3/p+1/t18-/m0/s1