(E)-3-(1,3-benzothiazol-2-yl)-4-(4-phenoxyphenyl)but-3-enoate

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(4-phenoxyphenyl)but-3-enoate Openeye Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(4-phenoxyphenyl)but-3-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(4-phenoxyphenyl)-3-butenoate IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(4-phenoxyphenyl)but-3-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(4-phenoxyphenyl)but-3-enoate Formula: C23H16NO3S- MolecularWeight: 386.44304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C=C(CC(=O)[O-])C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)/C=C(\CC(=O)[O-])/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H17NO3S/c25-22(26)15-17(23-24-20-8-4-5-9-21(20)28-23)14-16-10-12-19(13-11-16)27-18-6-2-1-3-7-18/h1-14H,15H2,(H,25,26)/p-1/b17-14+