[(1S)-2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: [(1S)-2-[2-cyanoethyl(phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: [(1S)-2-[N-(2-cyanoethyl)anilino]-2-oxo-1-phenyl-ethyl]ammonium CAS Name: [(1S)-2-[N-(2-cyanoethyl)anilino]-2-oxo-1-phenylethyl]ammonium IUPAC Name: [(1S)-2-[N-(2-cyanoethyl)anilino]-2-oxo-1-phenylethyl]azanium Traditional Name: [(1S)-2-[N-(2-cyanoethyl)anilino]-2-keto-1-phenyl-ethyl]ammonium Formula: C17H18N3O+ MolecularWeight: 280.34432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N(CCC#N)C2=CC=CC=C2)[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C(=O)N(CCC#N)C2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C17H17N3O/c18-12-7-13-20(15-10-5-2-6-11-15)17(21)16(19)14-8-3-1-4-9-14/h1-6,8-11,16H,7,13,19H2/p+1/t16-/m0/s1