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

Systemtic Name: [(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl]-cycloheptyl-azanium Openeye Name: [(1R)-2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl]-cycloheptyl-ammonium CAS Name: [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl]-cycloheptylammonium IUPAC Name: [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl]-cycloheptylazanium Traditional Name: [(1R)-2-(3-cyanoanilino)-2-keto-1-methyl-ethyl]-cycloheptyl-ammonium Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C#N)[NH2+]C2CCCCCC2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C#N)[NH2+]C2CCCCCC2

InChI

InChI=1S/C17H23N3O/c1-13(19-15-8-4-2-3-5-9-15)17(21)20-16-10-6-7-14(11-16)12-18/h6-7,10-11,13,15,19H,2-5,8-9H2,1H3,(H,20,21)/p+1/t13-/m1/s1