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

Systemtic Name: (4-iodophenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Openeye Name: (4-iodophenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzothiazol-2-yl)-2-propenoic acid (4-iodophenyl) ester IUPAC Name: (4-iodophenyl) (E)-3-(1,3-benzothiazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzothiazol-2-yl)acrylic acid (4-iodophenyl) ester Formula: C16H10INO2S MolecularWeight: 407.22557

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C=CC(=O)OC3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C=C/C(=O)OC3=CC=C(C=C3)I

InChI

InChI=1S/C16H10INO2S/c17-11-5-7-12(8-6-11)20-16(19)10-9-15-18-13-3-1-2-4-14(13)21-15/h1-10H/b10-9+