methyl 4-[2-(1,3-benzothiazol-2-yl)-2-oxidanyl-ethenyl]benzoate

Systemtic Name: methyl 4-[2-(1,3-benzothiazol-2-yl)-2-oxidanyl-ethenyl]benzoate Openeye Name: methyl 4-[2-(1,3-benzothiazol-2-yl)-2-hydroxy-vinyl]benzoate CAS Name: 4-[2-(1,3-benzothiazol-2-yl)-2-hydroxyethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(1,3-benzothiazol-2-yl)-2-hydroxyethenyl]benzoate Traditional Name: 4-[2-(1,3-benzothiazol-2-yl)-2-hydroxy-vinyl]benzoic acid methyl ester Formula: C17H13NO3S MolecularWeight: 311.35502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13NO3S/c1-21-17(20)12-8-6-11(7-9-12)10-14(19)16-18-13-4-2-3-5-15(13)22-16/h2-10,19H,1H3