[(2R)-1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl]-[(2S)-pentan-2-yl]azanium

Systemtic Name: [(2R)-1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl]-[(2S)-pentan-2-yl]azanium Openeye Name: [(1S)-1-methylbutyl]-[(1R)-1-methyl-2-oxo-2-(4-phenoxyanilino)ethyl]ammonium CAS Name: [(2R)-1-oxo-1-(4-phenoxyanilino)propan-2-yl]-[(2S)-pentan-2-yl]ammonium IUPAC Name: [(2R)-1-oxo-1-(4-phenoxyanilino)propan-2-yl]-[(2S)-pentan-2-yl]azanium Traditional Name: [(1R)-2-keto-1-methyl-2-(4-phenoxyanilino)ethyl]-[(1S)-1-methylbutyl]ammonium Formula: C20H27N2O2+ MolecularWeight: 327.44058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]C(C)C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CCC[C@H](C)[NH2+][C@H](C)C(=O)NC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O2/c1-4-8-15(2)21-16(3)20(23)22-17-11-13-19(14-12-17)24-18-9-6-5-7-10-18/h5-7,9-16,21H,4,8H2,1-3H3,(H,22,23)/p+1/t15-,16+/m0/s1