[2-[(1-cyanocycloheptyl)amino]-2-oxidanylidene-ethyl]-[(3-methoxyphenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(1-cyanocycloheptyl)amino]-2-oxidanylidene-ethyl]-[(3-methoxyphenyl)methyl]-methyl-azanium Openeye Name: [2-[(1-cyanocycloheptyl)amino]-2-oxo-ethyl]-[(3-methoxyphenyl)methyl]-methyl-ammonium CAS Name: [2-[(1-cyanocycloheptyl)amino]-2-oxoethyl]-[(3-methoxyphenyl)methyl]-methylammonium IUPAC Name: [2-[(1-cyanocycloheptyl)amino]-2-oxoethyl]-[(3-methoxyphenyl)methyl]-methylazanium Traditional Name: [2-[(1-cyanocycloheptyl)amino]-2-keto-ethyl]-m-anisyl-methyl-ammonium Formula: C19H28N3O2+ MolecularWeight: 330.44452

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC)CC(=O)NC2(CCCCCC2)C#N

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC)CC(=O)NC2(CCCCCC2)C#N

InChI

InChI=1S/C19H27N3O2/c1-22(13-16-8-7-9-17(12-16)24-2)14-18(23)21-19(15-20)10-5-3-4-6-11-19/h7-9,12H,3-6,10-11,13-14H2,1-2H3,(H,21,23)/p+1