3-[(1S,2R)-2-(6-chloranylpyridin-3-yl)cyclopent-3-en-1-yl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[(1S,2R)-2-(6-chloranylpyridin-3-yl)cyclopent-3-en-1-yl]-2H-phthalazine-1,4-dione Openeye Name: 3-[(1S,2R)-2-(6-chloro-3-pyridyl)cyclopent-3-en-1-yl]-2H-phthalazine-1,4-dione CAS Name: 3-[(1S,2R)-2-(6-chloro-3-pyridinyl)-1-cyclopent-3-enyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[(1S,2R)-2-(6-chloropyridin-3-yl)cyclopent-3-en-1-yl]-2H-phthalazine-1,4-dione Traditional Name: 3-[(1S,2R)-2-(6-chloro-3-pyridyl)cyclopent-3-en-1-yl]-2H-phthalazine-1,4-quinone Formula: C18H14ClN3O2 MolecularWeight: 339.77566

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC(C1N2C(=O)C3=CC=CC=C3C(=O)N2)C4=CN=C(C=C4)Cl

Isomeric SMILES

C1C=C[C@@H]([C@H]1N2C(=O)C3=CC=CC=C3C(=O)N2)C4=CN=C(C=C4)Cl

InChI

InChI=1S/C18H14ClN3O2/c19-16-9-8-11(10-20-16)12-6-3-7-15(12)22-18(24)14-5-2-1-4-13(14)17(23)21-22/h1-6,8-10,12,15H,7H2,(H,21,23)/t12-,15+/m1/s1