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

Systemtic Name: [(2S)-1-[(2-chloranyl-5-methoxycarbonyl-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[(2-chloro-5-methoxycarbonyl-phenyl)carbamoyl]-2-methyl-propyl]ammonium CAS Name: [(2S)-1-(2-chloro-5-methoxycarbonylanilino)-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(2-chloro-5-methoxycarbonylanilino)-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[(5-carbomethoxy-2-chloro-phenyl)carbamoyl]-2-methyl-propyl]ammonium Formula: C13H18ClN2O3+ MolecularWeight: 285.74662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=C(C=CC(=C1)C(=O)OC)Cl)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=C(C=CC(=C1)C(=O)OC)Cl)[NH3+]

InChI

InChI=1S/C13H17ClN2O3/c1-7(2)11(15)12(17)16-10-6-8(13(18)19-3)4-5-9(10)14/h4-7,11H,15H2,1-3H3,(H,16,17)/p+1/t11-/m0/s1