(E)-3-[5,5,6,6,7,7-hexakis(chloranyl)-2-(cyclohepten-1-yl)cyclohepten-1-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[5,5,6,6,7,7-hexakis(chloranyl)-2-(cyclohepten-1-yl)cyclohepten-1-yl]prop-2-enoic acid Openeye Name: (E)-3-[5,5,6,6,7,7-hexachloro-2-(cyclohepten-1-yl)cyclohepten-1-yl]prop-2-enoic acid CAS Name: (E)-3-[5,5,6,6,7,7-hexachloro-2-(1-cycloheptenyl)-1-cycloheptenyl]-2-propenoic acid IUPAC Name: (E)-3-[5,5,6,6,7,7-hexachloro-2-(cyclohepten-1-yl)cyclohepten-1-yl]prop-2-enoic acid Traditional Name: (E)-3-[5,5,6,6,7,7-hexachloro-2-(cyclohepten-1-yl)cyclohepten-1-yl]acrylic acid Formula: C17H18Cl6O2 MolecularWeight: 467.04162

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC=C(CC1)C2=C(C(C(C(CC2)(Cl)Cl)(Cl)Cl)(Cl)Cl)C=CC(=O)O

Isomeric SMILES

C1CCC=C(CC1)C2=C(C(C(C(CC2)(Cl)Cl)(Cl)Cl)(Cl)Cl)/C=C/C(=O)O

InChI

InChI=1S/C17H18Cl6O2/c18-15(19)10-9-12(11-5-3-1-2-4-6-11)13(7-8-14(24)25)16(20,21)17(15,22)23/h5,7-8H,1-4,6,9-10H2,(H,24,25)/b8-7+