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

Systemtic Name: [(2S,3S)-1-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[(4-chloro-2-methoxy-5-methyl-phenyl)carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-(4-chloro-2-methoxy-5-methylanilino)-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-(4-chloro-2-methoxy-5-methylanilino)-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[(4-chloro-2-methoxy-5-methyl-phenyl)carbamoyl]-2-methyl-butyl]ammonium Formula: C14H22ClN2O2+ MolecularWeight: 285.78968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21ClN2O2/c1-5-8(2)13(16)14(18)17-11-6-9(3)10(15)7-12(11)19-4/h6-8,13H,5,16H2,1-4H3,(H,17,18)/p+1/t8-,13-/m0/s1