(2,4-dimethylphenyl)methyl-methyl-[2-oxidanylidene-2-[[(2R)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]azanium

Systemtic Name: (2,4-dimethylphenyl)methyl-methyl-[2-oxidanylidene-2-[[(2R)-3-oxidanylidene-1-phenyl-butan-2-yl]amino]ethyl]azanium Openeye Name: [2-[[(1R)-1-benzyl-2-oxo-propyl]amino]-2-oxo-ethyl]-[(2,4-dimethylphenyl)methyl]-methyl-ammonium CAS Name: (2,4-dimethylphenyl)methyl-methyl-[2-oxo-2-[[(2R)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]ammonium IUPAC Name: (2,4-dimethylphenyl)methyl-methyl-[2-oxo-2-[[(2R)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]azanium Traditional Name: [2-[[(1R)-1-benzyl-2-keto-propyl]amino]-2-keto-ethyl]-(2,4-dimethylbenzyl)-methyl-ammonium Formula: C22H29N2O2+ MolecularWeight: 353.47786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C[NH+](C)CC(=O)NC(CC2=CC=CC=C2)C(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C[NH+](C)CC(=O)N[C@H](CC2=CC=CC=C2)C(=O)C)C

InChI

InChI=1S/C22H28N2O2/c1-16-10-11-20(17(2)12-16)14-24(4)15-22(26)23-21(18(3)25)13-19-8-6-5-7-9-19/h5-12,21H,13-15H2,1-4H3,(H,23,26)/p+1/t21-/m1/s1