[2-[[[(2S,3S)-2-benzamido-3-methyl-pentanoyl]amino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [2-[[[(2S,3S)-2-benzamido-3-methyl-pentanoyl]amino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [2-[[[(2S,3S)-2-benzamido-3-methyl-pentanoyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [2-[[[(2S,3S)-2-benzamido-3-methyl-1-oxopentyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [2-[[[(2S,3S)-2-benzamido-3-methylpentanoyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [2-[[[(2S,3S)-2-benzamido-3-methyl-pentanoyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NCC1=CC=CC=C1C[NH+](C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)NCC1=CC=CC=C1C[NH+](C)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H31N3O2/c1-5-17(2)21(25-22(27)18-11-7-6-8-12-18)23(28)24-15-19-13-9-10-14-20(19)16-26(3)4/h6-14,17,21H,5,15-16H2,1-4H3,(H,24,28)(H,25,27)/p+1/t17-,21-/m0/s1