[(2R)-1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2R)-1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1R)-1-[(4-chloro-2-methoxy-5-methyl-phenyl)carbamoyl]-3-methylsulfonyl-propyl]ammonium CAS Name: [(2R)-1-(4-chloro-2-methoxy-5-methylanilino)-4-methylsulfonyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2R)-1-(4-chloro-2-methoxy-5-methylanilino)-4-methylsulfonyl-1-oxobutan-2-yl]azanium Traditional Name: [(1R)-1-[(4-chloro-2-methoxy-5-methyl-phenyl)carbamoyl]-3-mesyl-propyl]ammonium Formula: C13H20ClN2O4S+ MolecularWeight: 335.8269

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(CCS(=O)(=O)C)[NH3+]

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)[C@@H](CCS(=O)(=O)C)[NH3+]

InChI

InChI=1S/C13H19ClN2O4S/c1-8-6-11(12(20-2)7-9(8)14)16-13(17)10(15)4-5-21(3,18)19/h6-7,10H,4-5,15H2,1-3H3,(H,16,17)/p+1/t10-/m1/s1