[(2S)-1-[[4-(2,5-dimethylphenoxy)phenyl]amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[[4-(2,5-dimethylphenoxy)phenyl]amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[4-(2,5-dimethylphenoxy)anilino]-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[4-(2,5-dimethylphenoxy)anilino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(2,5-dimethylphenoxy)anilino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-[4-(2,5-dimethylphenoxy)anilino]-2-keto-1-methyl-ethyl]ammonium Formula: C17H21N2O2+ MolecularWeight: 285.36084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=CC=C(C=C2)NC(=O)C(C)[NH3+]

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=CC=C(C=C2)NC(=O)[C@H](C)[NH3+]

InChI

InChI=1S/C17H20N2O2/c1-11-4-5-12(2)16(10-11)21-15-8-6-14(7-9-15)19-17(20)13(3)18/h4-10,13H,18H2,1-3H3,(H,19,20)/p+1/t13-/m0/s1