2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-hydroxyphenyl)ethenyl]sulfanylethanoic acid

Systemtic Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-hydroxyphenyl)ethenyl]sulfanylethanoic acid Openeye Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-hydroxyphenyl)vinyl]sulfanylacetic acid CAS Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-hydroxyphenyl)ethenyl]thio]acetic acid IUPAC Name: 2-[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-hydroxyphenyl)ethenyl]sulfanylacetic acid Traditional Name: 2-[[(Z)-1-(1,3-benzothiazol-2-yl)-2-(3-hydroxyphenyl)vinyl]thio]acetic acid Formula: C17H13NO3S2 MolecularWeight: 343.42002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13NO3S2/c19-12-5-3-4-11(8-12)9-15(22-10-16(20)21)17-18-13-6-1-2-7-14(13)23-17/h1-9,19H,10H2,(H,20,21)/b15-9-