dimethyl-[(2S)-2-phenyl-2-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoylamino]ethyl]azanium

Systemtic Name: dimethyl-[(2S)-2-phenyl-2-[2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoylamino]ethyl]azanium Openeye Name: dimethyl-[(2S)-2-phenyl-2-[[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]amino]ethyl]ammonium CAS Name: dimethyl-[(2S)-2-[[1-oxo-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]ethyl]amino]-2-phenylethyl]ammonium IUPAC Name: dimethyl-[(2S)-2-phenyl-2-[[2-[[(E)-3-phenylprop-2-enoyl]amino]acetyl]amino]ethyl]azanium Traditional Name: dimethyl-[(2S)-2-phenyl-2-[[2-[[(E)-3-phenylacryloyl]amino]acetyl]amino]ethyl]ammonium Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O2/c1-24(2)16-19(18-11-7-4-8-12-18)23-21(26)15-22-20(25)14-13-17-9-5-3-6-10-17/h3-14,19H,15-16H2,1-2H3,(H,22,25)(H,23,26)/p+1/b14-13+/t19-/m1/s1