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

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl (2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]propanoate Openeye Name: (7-hydroxy-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-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-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-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C22H19NO6 MolecularWeight: 393.38936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)O)NC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)O)NC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H19NO6/c1-14(23-20(25)10-7-15-5-3-2-4-6-15)22(27)28-13-16-11-21(26)29-19-12-17(24)8-9-18(16)19/h2-12,14,24H,13H2,1H3,(H,23,25)/b10-7+/t14-/m0/s1