[(2S)-1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl]-(phenylmethyl)azanium

Systemtic Name: [(2S)-1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl]-(phenylmethyl)azanium Openeye Name: benzyl-[(1S)-1-methyl-2-oxo-2-(4-phenoxyanilino)ethyl]ammonium CAS Name: [(2S)-1-oxo-1-(4-phenoxyanilino)propan-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(2S)-1-oxo-1-(4-phenoxyanilino)propan-2-yl]azanium Traditional Name: benzyl-[(1S)-2-keto-1-methyl-2-(4-phenoxyanilino)ethyl]ammonium Formula: C22H23N2O2+ MolecularWeight: 347.43022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)[NH2+]CC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2)[NH2+]CC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O2/c1-17(23-16-18-8-4-2-5-9-18)22(25)24-19-12-14-21(15-13-19)26-20-10-6-3-7-11-20/h2-15,17,23H,16H2,1H3,(H,24,25)/p+1/t17-/m0/s1