[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-[(3,4-dimethoxyphenyl)methyl]-methyl-azanium Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl]-[(3,4-dimethoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-[(3,4-dimethoxyphenyl)methyl]-methylammonium IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-[(3,4-dimethoxyphenyl)methyl]-methylazanium Traditional Name: [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl]-methyl-veratryl-ammonium Formula: C18H26N3O3+ MolecularWeight: 332.41734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O3/c1-21(11-14-6-7-15(23-2)16(10-14)24-3)12-17(22)20-18(13-19)8-4-5-9-18/h6-7,10H,4-5,8-9,11-12H2,1-3H3,(H,20,22)/p+1