(E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]prop-2-enoate

Systemtic Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]prop-2-enoate Openeye Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(2-ethoxy-2-oxo-ethoxy)phenyl]prop-2-enoate CAS Name: (E)-2-(1,3-benzoxazol-2-ylthio)-3-[4-(2-ethoxy-2-oxoethoxy)phenyl]-2-propenoate IUPAC Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-[4-(2-ethoxy-2-oxoethoxy)phenyl]prop-2-enoate Traditional Name: (E)-2-(1,3-benzoxazol-2-ylthio)-3-[4-(2-ethoxy-2-keto-ethoxy)phenyl]acrylate Formula: C20H16NO6S- MolecularWeight: 398.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=C(C=C1)C=C(C(=O)[O-])SC2=NC3=CC=CC=C3O2

Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)/C=C(\C(=O)[O-])/SC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C20H17NO6S/c1-2-25-18(22)12-26-14-9-7-13(8-10-14)11-17(19(23)24)28-20-21-15-5-3-4-6-16(15)27-20/h3-11H,2,12H2,1H3,(H,23,24)/p-1/b17-11+