[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl]-methyl-(p-tolylmethyl)ammonium CAS Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl]-methyl-(4-methylbenzyl)ammonium Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](C)CC(=O)NC2(CCCC2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](C)CC(=O)NC2(CCCC2)C#N

InChI

InChI=1S/C17H23N3O/c1-14-5-7-15(8-6-14)11-20(2)12-16(21)19-17(13-18)9-3-4-10-17/h5-8H,3-4,9-12H2,1-2H3,(H,19,21)/p+1