[(2S)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[(4-cyanophenyl)amino]-1-oxidanylidene-3-phenyl-propan-2-yl]azanium Openeye Name: [(1S)-1-benzyl-2-(4-cyanoanilino)-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-(4-cyanoanilino)-1-oxo-3-phenylpropan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-cyanoanilino)-1-oxo-3-phenylpropan-2-yl]azanium Traditional Name: [(1S)-1-benzyl-2-(4-cyanoanilino)-2-keto-ethyl]ammonium Formula: C16H16N3O+ MolecularWeight: 266.31774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC2=CC=C(C=C2)C#N)[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NC2=CC=C(C=C2)C#N)[NH3+]

InChI

InChI=1S/C16H15N3O/c17-11-13-6-8-14(9-7-13)19-16(20)15(18)10-12-4-2-1-3-5-12/h1-9,15H,10,18H2,(H,19,20)/p+1/t15-/m0/s1