phenacyl (2S)-2-[(3,4,5-trimethoxyphenyl)carbonylamino]propanoate

Systemtic Name: phenacyl (2S)-2-[(3,4,5-trimethoxyphenyl)carbonylamino]propanoate Openeye Name: phenacyl (2S)-2-[(3,4,5-trimethoxybenzoyl)amino]propanoate CAS Name: (2S)-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]propanoic acid phenacyl ester IUPAC Name: phenacyl (2S)-2-[(3,4,5-trimethoxybenzoyl)amino]propanoate Traditional Name: (2S)-2-[(3,4,5-trimethoxybenzoyl)amino]propionic acid phenacyl ester Formula: C21H23NO7 MolecularWeight: 401.40982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=CC=CC=C1)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)C1=CC=CC=C1)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C21H23NO7/c1-13(21(25)29-12-16(23)14-8-6-5-7-9-14)22-20(24)15-10-17(26-2)19(28-4)18(11-15)27-3/h5-11,13H,12H2,1-4H3,(H,22,24)/t13-/m0/s1