[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-azanium Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl]-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-methyl-ammonium CAS Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-[(4,5-dimethoxy-2-methylphenyl)methyl]-methylammonium IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-[(4,5-dimethoxy-2-methylphenyl)methyl]-methylazanium Traditional Name: [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl]-(4,5-dimethoxy-2-methyl-benzyl)-methyl-ammonium Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C[NH+](C)CC(=O)NC2(CCCC2)C#N)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+](C)CC(=O)NC2(CCCC2)C#N)OC)OC

InChI

InChI=1S/C19H27N3O3/c1-14-9-16(24-3)17(25-4)10-15(14)11-22(2)12-18(23)21-19(13-20)7-5-6-8-19/h9-10H,5-8,11-12H2,1-4H3,(H,21,23)/p+1