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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)C(C(C)CC)[NH3+]

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)[C@H]([C@@H](C)CC)[NH3+]

InChI

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