(E)-3-(1,3-benzoxazol-2-yl)-4-(3-prop-2-enoxyphenyl)but-3-enoic acid

Systemtic Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(3-prop-2-enoxyphenyl)but-3-enoic acid Openeye Name: (E)-4-(3-allyloxyphenyl)-3-(1,3-benzoxazol-2-yl)but-3-enoic acid CAS Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(3-prop-2-enoxyphenyl)-3-butenoic acid IUPAC Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(3-prop-2-enoxyphenyl)but-3-enoic acid Traditional Name: (E)-4-(3-allyloxyphenyl)-3-(1,3-benzoxazol-2-yl)but-3-enoic acid Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC(=C1)C=C(CC(=O)O)C2=NC3=CC=CC=C3O2

Isomeric SMILES

C=CCOC1=CC=CC(=C1)/C=C(\CC(=O)O)/C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C20H17NO4/c1-2-10-24-16-7-5-6-14(12-16)11-15(13-19(22)23)20-21-17-8-3-4-9-18(17)25-20/h2-9,11-12H,1,10,13H2,(H,22,23)/b15-11+