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

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(2-prop-2-enoxyphenyl)but-3-enoate Openeye Name: (E)-4-(2-allyloxyphenyl)-3-(1,3-benzothiazol-2-yl)but-3-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(2-prop-2-enoxyphenyl)-3-butenoate IUPAC Name: (E)-3-(1,3-benzothiazol-2-yl)-4-(2-prop-2-enoxyphenyl)but-3-enoate Traditional Name: (E)-4-(2-allyloxyphenyl)-3-(1,3-benzothiazol-2-yl)but-3-enoate Formula: C20H16NO3S- MolecularWeight: 350.41094

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1C=C(CC(=O)[O-])C2=NC3=CC=CC=C3S2

Isomeric SMILES

C=CCOC1=CC=CC=C1/C=C(\CC(=O)[O-])/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H17NO3S/c1-2-11-24-17-9-5-3-7-14(17)12-15(13-19(22)23)20-21-16-8-4-6-10-18(16)25-20/h2-10,12H,1,11,13H2,(H,22,23)/p-1/b15-12+