(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl (2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoate CAS Name: (2S)-2-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]propanoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl (2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoate Traditional Name: (2S)-2-[[(E)-3-phenylacryloyl]amino]propionic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C24H23NO5 MolecularWeight: 405.44312

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(C)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)[C@H](C)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H23NO5/c1-3-17-9-11-20-19(14-23(27)30-21(20)13-17)15-29-24(28)16(2)25-22(26)12-10-18-7-5-4-6-8-18/h4-14,16H,3,15H2,1-2H3,(H,25,26)/b12-10+/t16-/m0/s1