[(1S)-2-(3-imidazol-1-ylpropylamino)-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: [(1S)-2-(3-imidazol-1-ylpropylamino)-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: [(1S)-2-(3-imidazol-1-ylpropylamino)-2-oxo-1-phenyl-ethyl]ammonium CAS Name: [(1S)-2-[3-(1-imidazolyl)propylamino]-2-oxo-1-phenylethyl]ammonium IUPAC Name: [(1S)-2-(3-imidazol-1-ylpropylamino)-2-oxo-1-phenylethyl]azanium Traditional Name: [(1S)-2-(3-imidazol-1-ylpropylamino)-2-keto-1-phenyl-ethyl]ammonium Formula: C14H19N4O+ MolecularWeight: 259.32686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NCCCN2C=CN=C2)[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C(=O)NCCCN2C=CN=C2)[NH3+]

InChI

InChI=1S/C14H18N4O/c15-13(12-5-2-1-3-6-12)14(19)17-7-4-9-18-10-8-16-11-18/h1-3,5-6,8,10-11,13H,4,7,9,15H2,(H,17,19)/p+1/t13-/m0/s1