4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)ethenyl]benzoate

Systemtic Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)ethenyl]benzoate Openeye Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)vinyl]benzoate CAS Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)ethenyl]benzoate IUPAC Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)ethenyl]benzoate Traditional Name: 4-[(E)-2-(5,6-dimethyl-1,3-benzothiazol-2-yl)vinyl]benzoate Formula: C18H14NO2S- MolecularWeight: 308.37426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)SC(=N2)C=CC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)SC(=N2)/C=C/C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C18H15NO2S/c1-11-9-15-16(10-12(11)2)22-17(19-15)8-5-13-3-6-14(7-4-13)18(20)21/h3-10H,1-2H3,(H,20,21)/p-1/b8-5+