(E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-prop-2-ynoxyphenyl)prop-2-enoate

Systemtic Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-prop-2-ynoxyphenyl)prop-2-enoate Openeye Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-prop-2-ynoxyphenyl)prop-2-enoate CAS Name: (E)-2-(1,3-benzoxazol-2-ylthio)-3-(4-prop-2-ynoxyphenyl)-2-propenoate IUPAC Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(4-prop-2-ynoxyphenyl)prop-2-enoate Traditional Name: (E)-2-(1,3-benzoxazol-2-ylthio)-3-(4-propargyloxyphenyl)acrylate Formula: C19H12NO4S- MolecularWeight: 350.36788

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=C(C=C1)C=C(C(=O)[O-])SC2=NC3=CC=CC=C3O2

Isomeric SMILES

C#CCOC1=CC=C(C=C1)/C=C(\C(=O)[O-])/SC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C19H13NO4S/c1-2-11-23-14-9-7-13(8-10-14)12-17(18(21)22)25-19-20-15-5-3-4-6-16(15)24-19/h1,3-10,12H,11H2,(H,21,22)/p-1/b17-12+