(E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(3-prop-2-enoxyphenyl)prop-2-enoic acid

Systemtic Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(3-prop-2-enoxyphenyl)prop-2-enoic acid Openeye Name: (E)-3-(3-allyloxyphenyl)-2-(1,3-benzoxazol-2-ylsulfanyl)prop-2-enoic acid CAS Name: (E)-2-(1,3-benzoxazol-2-ylthio)-3-(3-prop-2-enoxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-(1,3-benzoxazol-2-ylsulfanyl)-3-(3-prop-2-enoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3-allyloxyphenyl)-2-(1,3-benzoxazol-2-ylthio)acrylic acid Formula: C19H15NO4S MolecularWeight: 353.3917

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC(=C1)C=C(C(=O)O)SC2=NC3=CC=CC=C3O2

Isomeric SMILES

C=CCOC1=CC=CC(=C1)/C=C(\C(=O)O)/SC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C19H15NO4S/c1-2-10-23-14-7-5-6-13(11-14)12-17(18(21)22)25-19-20-15-8-3-4-9-16(15)24-19/h2-9,11-12H,1,10H2,(H,21,22)/b17-12+