2-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]benzoic acid

Systemtic Name: 2-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]benzoic acid Openeye Name: 2-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]benzoic acid CAS Name: 2-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]benzoic acid IUPAC Name: 2-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]benzoic acid Traditional Name: 2-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]benzoic acid Formula: C16H11NO2S MolecularWeight: 281.32904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC2=NC3=CC=CC=C3S2)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C2=NC3=CC=CC=C3S2)C(=O)O

InChI

InChI=1S/C16H11NO2S/c18-16(19)12-6-2-1-5-11(12)9-10-15-17-13-7-3-4-8-14(13)20-15/h1-10H,(H,18,19)/b10-9+