[(2S)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoate

Systemtic Name: [(2S)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-[[(E)-3-phenylprop-2-enoyl]amino]ethanoate Openeye Name: [(1S)-2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 2-[[(E)-3-phenylprop-2-enoyl]amino]acetate CAS Name: 2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]acetic acid [(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] 2-[[(E)-3-phenylprop-2-enoyl]amino]acetate Traditional Name: 2-[[(E)-3-phenylacryloyl]amino]acetic acid [(1S)-2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C22H20N2O4 MolecularWeight: 376.4052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CNC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)C1=CNC2=CC=CC=C21)OC(=O)CNC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H20N2O4/c1-15(22(27)18-13-23-19-10-6-5-9-17(18)19)28-21(26)14-24-20(25)12-11-16-7-3-2-4-8-16/h2-13,15,23H,14H2,1H3,(H,24,25)/b12-11+/t15-/m0/s1