3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-phenylpropanoylamino)propanoic acid

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-phenylpropanoylamino)propanoic acid Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-phenylpropanoylamino)propanoic acid CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(1-oxo-3-phenylpropyl)amino]propanoic acid IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-phenylpropanoylamino)propanoic acid Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(hydrocinnamoylamino)propionic acid Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CC(C(=O)O)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CC(C(=O)O)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H21NO5/c22-19(9-7-14-4-2-1-3-5-14)21-16(20(23)24)12-15-6-8-17-18(13-15)26-11-10-25-17/h1-6,8,13,16H,7,9-12H2,(H,21,22)(H,23,24)