[4-[[[(2S)-2-benzamido-3-phenyl-propanoyl]amino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[[[(2S)-2-benzamido-3-phenyl-propanoyl]amino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[[(2S)-2-benzamido-3-phenyl-propanoyl]amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[(2S)-2-benzamido-1-oxo-3-phenylpropyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[[(2S)-2-benzamido-3-phenylpropanoyl]amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[[(2S)-2-benzamido-3-phenyl-propanoyl]amino]methyl]benzyl]-dimethyl-ammonium Formula: C26H30N3O2+ MolecularWeight: 416.5353

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H29N3O2/c1-29(2)19-22-15-13-21(14-16-22)18-27-26(31)24(17-20-9-5-3-6-10-20)28-25(30)23-11-7-4-8-12-23/h3-16,24H,17-19H2,1-2H3,(H,27,31)(H,28,30)/p+1/t24-/m0/s1