[2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl]-cyclooctyl-azanium

Systemtic Name: [2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxidanylidene-ethyl]-cyclooctyl-azanium Openeye Name: [2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-oxo-ethyl]-cyclooctyl-ammonium CAS Name: [2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl]-cyclooctylammonium IUPAC Name: [2-[[(1R)-1-cyano-1-cyclopropylethyl]amino]-2-oxoethyl]-cyclooctylazanium Traditional Name: [2-[[(1R)-1-cyano-1-cyclopropyl-ethyl]amino]-2-keto-ethyl]-cyclooctyl-ammonium Formula: C16H28N3O+ MolecularWeight: 278.41302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)C[NH2+]C2CCCCCCC2

Isomeric SMILES

C[C@](C#N)(C1CC1)NC(=O)C[NH2+]C2CCCCCCC2

InChI

InChI=1S/C16H27N3O/c1-16(12-17,13-9-10-13)19-15(20)11-18-14-7-5-3-2-4-6-8-14/h13-14,18H,2-11H2,1H3,(H,19,20)/p+1/t16-/m0/s1