[(2S)-1-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[(4-chloro-2,5-dimethoxy-phenyl)carbamoyl]-2-methyl-propyl]ammonium CAS Name: [(2S)-1-(4-chloro-2,5-dimethoxyanilino)-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(4-chloro-2,5-dimethoxyanilino)-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(4-chloro-2,5-dimethoxy-phenyl)carbamoyl]-2-methyl-propyl]ammonium Formula: C13H20ClN2O3+ MolecularWeight: 287.7625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=C(C=C1OC)Cl)OC)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC(=C(C=C1OC)Cl)OC)[NH3+]

InChI

InChI=1S/C13H19ClN2O3/c1-7(2)12(15)13(17)16-9-6-10(18-3)8(14)5-11(9)19-4/h5-7,12H,15H2,1-4H3,(H,16,17)/p+1/t12-/m0/s1