(4-chlorophenyl)methyl-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium

Systemtic Name: (4-chlorophenyl)methyl-[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl]azanium Openeye Name: [(1S)-2-anilino-1-methyl-2-oxo-ethyl]-[(4-chlorophenyl)methyl]ammonium CAS Name: [(2S)-1-anilino-1-oxopropan-2-yl]-[(4-chlorophenyl)methyl]ammonium IUPAC Name: [(2S)-1-anilino-1-oxopropan-2-yl]-[(4-chlorophenyl)methyl]azanium Traditional Name: [(1S)-2-anilino-2-keto-1-methyl-ethyl]-(4-chlorobenzyl)ammonium Formula: C16H18ClN2O+ MolecularWeight: 289.77992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH2+]CC2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1)[NH2+]CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClN2O/c1-12(16(20)19-15-5-3-2-4-6-15)18-11-13-7-9-14(17)10-8-13/h2-10,12,18H,11H2,1H3,(H,19,20)/p+1/t12-/m0/s1