(E)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-4-keto-but-2-enoic acid Formula: C14H15NO5 MolecularWeight: 277.2726

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCNC(=O)C=CC(=O)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCNC(=O)/C=C/C(=O)O

InChI

InChI=1S/C14H15NO5/c16-13(3-4-14(17)18)15-6-5-10-1-2-11-12(9-10)20-8-7-19-11/h1-4,9H,5-8H2,(H,15,16)(H,17,18)/b4-3+