6-[2-(2-acetyloxy-5-chloranyl-phenyl)cyclopenten-1-yl]pyridazine-4-carboxylic acid

Systemtic Name: 6-[2-(2-acetyloxy-5-chloranyl-phenyl)cyclopenten-1-yl]pyridazine-4-carboxylic acid Openeye Name: 6-[2-(2-acetoxy-5-chloro-phenyl)cyclopenten-1-yl]pyridazine-4-carboxylic acid CAS Name: 6-[2-(2-acetyloxy-5-chlorophenyl)-1-cyclopentenyl]-4-pyridazinecarboxylic acid IUPAC Name: 6-[2-(2-acetyloxy-5-chlorophenyl)cyclopenten-1-yl]pyridazine-4-carboxylic acid Traditional Name: 6-[2-(2-acetoxy-5-chloro-phenyl)cyclopenten-1-yl]pyridazine-4-carboxylic acid Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)Cl)C2=C(CCC2)C3=NN=CC(=C3)C(=O)O

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)Cl)C2=C(CCC2)C3=NN=CC(=C3)C(=O)O

InChI

InChI=1S/C18H15ClN2O4/c1-10(22)25-17-6-5-12(19)8-15(17)13-3-2-4-14(13)16-7-11(18(23)24)9-20-21-16/h5-9H,2-4H2,1H3,(H,23,24)