(E)-2-(1,3-benzoxazol-2-yl)-3-[(4-iodophenyl)amino]prop-2-enenitrile

Systemtic Name: (E)-2-(1,3-benzoxazol-2-yl)-3-[(4-iodophenyl)amino]prop-2-enenitrile Openeye Name: (E)-2-(1,3-benzoxazol-2-yl)-3-(4-iodoanilino)prop-2-enenitrile CAS Name: (E)-2-(1,3-benzoxazol-2-yl)-3-(4-iodoanilino)-2-propenenitrile IUPAC Name: (E)-2-(1,3-benzoxazol-2-yl)-3-(4-iodoanilino)prop-2-enenitrile Traditional Name: (E)-2-(1,3-benzoxazol-2-yl)-3-(4-iodoanilino)acrylonitrile Formula: C16H10IN3O MolecularWeight: 387.17457

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C(=CNC3=CC=C(C=C3)I)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)/C(=C/NC3=CC=C(C=C3)I)/C#N

InChI

InChI=1S/C16H10IN3O/c17-12-5-7-13(8-6-12)19-10-11(9-18)16-20-14-3-1-2-4-15(14)21-16/h1-8,10,19H/b11-10+