(E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-hydroxyphenyl)prop-2-enoic acid

Systemtic Name: (E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-hydroxyphenyl)prop-2-enoic acid Openeye Name: (E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-hydroxyphenyl)prop-2-enoic acid CAS Name: (E)-2-(1,3-benzothiazol-2-ylthio)-3-(4-hydroxyphenyl)-2-propenoic acid IUPAC Name: (E)-2-(1,3-benzothiazol-2-ylsulfanyl)-3-(4-hydroxyphenyl)prop-2-enoic acid Traditional Name: (E)-2-(1,3-benzothiazol-2-ylthio)-3-(4-hydroxyphenyl)acrylic acid Formula: C16H11NO3S2 MolecularWeight: 329.39344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC(=CC3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)S/C(=C/C3=CC=C(C=C3)O)/C(=O)O

InChI

InChI=1S/C16H11NO3S2/c18-11-7-5-10(6-8-11)9-14(15(19)20)22-16-17-12-3-1-2-4-13(12)21-16/h1-9,18H,(H,19,20)/b14-9+