(E)-3-[5-[(Z)-4-morpholin-4-yl-4-oxidanylidene-but-2-en-2-yl]-1-benzofuran-2-yl]but-2-enoic acid

Systemtic Name: (E)-3-[5-[(Z)-4-morpholin-4-yl-4-oxidanylidene-but-2-en-2-yl]-1-benzofuran-2-yl]but-2-enoic acid Openeye Name: (E)-3-[5-[(Z)-1-methyl-3-morpholino-3-oxo-prop-1-enyl]benzofuran-2-yl]but-2-enoic acid CAS Name: (E)-3-[5-[(Z)-4-(4-morpholinyl)-4-oxobut-2-en-2-yl]-2-benzofuranyl]-2-butenoic acid IUPAC Name: (E)-3-[5-[(Z)-4-morpholin-4-yl-4-oxobut-2-en-2-yl]-1-benzofuran-2-yl]but-2-enoic acid Traditional Name: (E)-3-[5-[(Z)-3-keto-1-methyl-3-morpholino-prop-1-enyl]benzofuran-2-yl]but-2-enoic acid Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCOCC1)C2=CC3=C(C=C2)OC(=C3)C(=CC(=O)O)C

Isomeric SMILES

C/C(=C/C(=O)N1CCOCC1)/C2=CC3=C(C=C2)OC(=C3)/C(=C/C(=O)O)/C

InChI

InChI=1S/C20H21NO5/c1-13(9-19(22)21-5-7-25-8-6-21)15-3-4-17-16(11-15)12-18(26-17)14(2)10-20(23)24/h3-4,9-12H,5-8H2,1-2H3,(H,23,24)/b13-9-,14-10+