methyl-[(2S)-1-oxidanylidene-1-[[(1R)-1-phenylbutyl]amino]propan-2-yl]-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium

Systemtic Name: methyl-[(2S)-1-oxidanylidene-1-[[(1R)-1-phenylbutyl]amino]propan-2-yl]-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]azanium Openeye Name: methyl-[(1S)-1-methyl-2-oxo-2-[[(1R)-1-phenylbutyl]amino]ethyl]-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium CAS Name: methyl-[(2S)-1-oxo-1-[[(1R)-1-phenylbutyl]amino]propan-2-yl]-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]ammonium IUPAC Name: methyl-[(2S)-1-oxo-1-[[(1R)-1-phenylbutyl]amino]propan-2-yl]-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium Traditional Name: (2-keto-2-mesidino-ethyl)-[(1S)-2-keto-1-methyl-2-[[(1R)-1-phenylbutyl]amino]ethyl]-methyl-ammonium Formula: C25H36N3O2+ MolecularWeight: 410.57224

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)[NH+](C)CC(=O)NC2=C(C=C(C=C2C)C)C

Isomeric SMILES

CCC[C@H](C1=CC=CC=C1)NC(=O)[C@H](C)[NH+](C)CC(=O)NC2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C25H35N3O2/c1-7-11-22(21-12-9-8-10-13-21)26-25(30)20(5)28(6)16-23(29)27-24-18(3)14-17(2)15-19(24)4/h8-10,12-15,20,22H,7,11,16H2,1-6H3,(H,26,30)(H,27,29)/p+1/t20-,22+/m0/s1