(E)-4-(1,3-benzothiazol-2-yl)-5-(2,3-dimethoxyphenyl)pent-4-enoic acid

Systemtic Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(2,3-dimethoxyphenyl)pent-4-enoic acid Openeye Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(2,3-dimethoxyphenyl)pent-4-enoic acid CAS Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(2,3-dimethoxyphenyl)-4-pentenoic acid IUPAC Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(2,3-dimethoxyphenyl)pent-4-enoic acid Traditional Name: (E)-4-(1,3-benzothiazol-2-yl)-5-(2,3-dimethoxyphenyl)pent-4-enoic acid Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=C(CCC(=O)O)C2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=C(\CCC(=O)O)/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H19NO4S/c1-24-16-8-5-6-13(19(16)25-2)12-14(10-11-18(22)23)20-21-15-7-3-4-9-17(15)26-20/h3-9,12H,10-11H2,1-2H3,(H,22,23)/b14-12+