[(2S)-1-[[4-(2-methoxy-4-methyl-phenoxy)phenyl]amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[[4-(2-methoxy-4-methyl-phenoxy)phenyl]amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-2-[4-(2-methoxy-4-methyl-phenoxy)anilino]-1-methyl-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[4-(2-methoxy-4-methylphenoxy)anilino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(2-methoxy-4-methylphenoxy)anilino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-keto-2-[4-(2-methoxy-4-methyl-phenoxy)anilino]-1-methyl-ethyl]ammonium Formula: C17H21N2O3+ MolecularWeight: 301.36024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O3/c1-11-4-9-15(16(10-11)21-3)22-14-7-5-13(6-8-14)19-17(20)12(2)18/h4-10,12H,18H2,1-3H3,(H,19,20)/p+1/t12-/m0/s1