[(2S)-1-[ethyl-(3-methylphenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium

Systemtic Name: [(2S)-1-[ethyl-(3-methylphenyl)amino]-4-methyl-1-oxidanylidene-pentan-2-yl]azanium Openeye Name: [(1S)-1-[ethyl(m-tolyl)carbamoyl]-3-methyl-butyl]ammonium CAS Name: [(2S)-1-(N-ethyl-3-methylanilino)-4-methyl-1-oxopentan-2-yl]ammonium IUPAC Name: [(2S)-1-(N-ethyl-3-methylanilino)-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1S)-1-[ethyl(m-tolyl)carbamoyl]-3-methyl-butyl]ammonium Formula: C15H25N2O+ MolecularWeight: 249.3718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C(=O)C(CC(C)C)[NH3+]

Isomeric SMILES

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

InChI

InChI=1S/C15H24N2O/c1-5-17(13-8-6-7-12(4)10-13)15(18)14(16)9-11(2)3/h6-8,10-11,14H,5,9,16H2,1-4H3/p+1/t14-/m0/s1