[(2S,3S)-1-[(2-ethyl-6-methyl-phenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-1-[(2-ethyl-6-methyl-phenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[(2-ethyl-6-methyl-phenyl)carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-(2-ethyl-6-methylanilino)-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-(2-ethyl-6-methylanilino)-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[(2-ethyl-6-methyl-phenyl)carbamoyl]-2-methyl-butyl]ammonium Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(C(C)CC)[NH3+])C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)[C@H]([C@@H](C)CC)[NH3+])C

InChI

InChI=1S/C15H24N2O/c1-5-10(3)13(16)15(18)17-14-11(4)8-7-9-12(14)6-2/h7-10,13H,5-6,16H2,1-4H3,(H,17,18)/p+1/t10-,13-/m0/s1