[(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-cyclohexyl-azanium

Systemtic Name: [(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-cyclohexyl-azanium Openeye Name: [(1R)-2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl]-cyclohexyl-ammonium CAS Name: [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl]-cyclohexylammonium IUPAC Name: [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl]-cyclohexylazanium Traditional Name: [(1R)-2-(3-cyanoanilino)-2-keto-1-methyl-ethyl]-cyclohexyl-ammonium Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)[NH2+]C2CCCCC2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C#N)[NH2+]C2CCCCC2

InChI

InChI=1S/C16H21N3O/c1-12(18-14-7-3-2-4-8-14)16(20)19-15-9-5-6-13(10-15)11-17/h5-6,9-10,12,14,18H,2-4,7-8H2,1H3,(H,19,20)/p+1/t12-/m1/s1