[2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[(1-cyanocyclohexyl)-methyl-amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl]-methylazanium Traditional Name: benzyl-[2-[(1-cyanocyclohexyl)-methyl-amino]-2-keto-ethyl]-methyl-ammonium Formula: C18H26N3O+ MolecularWeight: 300.41854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(=O)N(C)C2(CCCCC2)C#N

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC(=O)N(C)C2(CCCCC2)C#N

InChI

InChI=1S/C18H25N3O/c1-20(13-16-9-5-3-6-10-16)14-17(22)21(2)18(15-19)11-7-4-8-12-18/h3,5-6,9-10H,4,7-8,11-14H2,1-2H3/p+1