(E)-3-(1,3-benzoxazol-2-yl)-4-(4-morpholin-4-ylphenyl)but-3-enoic acid

Systemtic Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-morpholin-4-ylphenyl)but-3-enoic acid Openeye Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-morpholinophenyl)but-3-enoic acid CAS Name: (E)-3-(1,3-benzoxazol-2-yl)-4-[4-(4-morpholinyl)phenyl]-3-butenoic acid IUPAC Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-morpholin-4-ylphenyl)but-3-enoic acid Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-morpholinophenyl)but-3-enoic acid Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C=C(CC(=O)O)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)/C=C(\CC(=O)O)/C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H20N2O4/c24-20(25)14-16(21-22-18-3-1-2-4-19(18)27-21)13-15-5-7-17(8-6-15)23-9-11-26-12-10-23/h1-8,13H,9-12,14H2,(H,24,25)/b16-13+