6-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-2-iodanyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-olate

Systemtic Name: 6-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-2-iodanyl-7-oxidanylidene-cyclohepta-1,3,5-trien-1-olate Openeye Name: 6-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-2-iodo-7-oxo-cyclohepta-1,3,5-trien-1-olate CAS Name: 6-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]-2-iodo-7-oxo-1-cyclohepta-1,3,5-trienolate IUPAC Name: 6-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-2-iodo-7-oxocyclohepta-1,3,5-trien-1-olate Traditional Name: 6-[(E)-3-(4-chlorophenyl)acryloyl]-2-iodo-7-keto-cyclohepta-1,3,5-trien-1-olate Formula: C16H9ClIO3- MolecularWeight: 411.59833

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=O)C(=C1)C(=O)C=CC2=CC=C(C=C2)Cl)[O-])I

Isomeric SMILES

C1=CC(=C(C(=O)C(=C1)C(=O)/C=C/C2=CC=C(C=C2)Cl)[O-])I

InChI

InChI=1S/C16H10ClIO3/c17-11-7-4-10(5-8-11)6-9-14(19)12-2-1-3-13(18)16(21)15(12)20/h1-9H,(H,20,21)/p-1/b9-6+