[(2S,3S)-1-[(2,5-dimethylphenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S,3S)-1-[(2,5-dimethylphenyl)amino]-3-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S,2S)-1-[(2,5-dimethylphenyl)carbamoyl]-2-methyl-butyl]ammonium CAS Name: [(2S,3S)-1-(2,5-dimethylanilino)-3-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S,3S)-1-(2,5-dimethylanilino)-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S,2S)-1-[(2,5-dimethylphenyl)carbamoyl]-2-methyl-butyl]ammonium Formula: C14H23N2O+ MolecularWeight: 235.34522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O/c1-5-10(3)13(15)14(17)16-12-8-9(2)6-7-11(12)4/h6-8,10,13H,5,15H2,1-4H3,(H,16,17)/p+1/t10-,13-/m0/s1