(E)-3-(1,3-benzothiazol-2-yl)-2-phenyl-prop-2-enoic acid

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-2-phenyl-prop-2-enoic acid Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-2-phenyl-prop-2-enoic acid CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-phenyl-2-propenoic acid IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-2-phenylprop-2-enoic acid Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-2-phenyl-acrylic 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(11-6-2-1-3-7-11)10-15-17-13-8-4-5-9-14(13)20-15/h1-10H,(H,18,19)/b12-10+