4-chloranyl-2-pent-4-ynyl-isoindole-1,3-dione

Systemtic Name: 4-chloranyl-2-pent-4-ynyl-isoindole-1,3-dione Openeye Name: 4-chloro-2-pent-4-ynyl-isoindoline-1,3-dione CAS Name: 4-chloro-2-pent-4-ynylisoindole-1,3-dione IUPAC Name: 4-chloro-2-pent-4-ynylisoindole-1,3-dione Traditional Name: 4-chloro-2-pent-4-ynyl-isoindoline-1,3-quinone Formula: C13H10ClNO2 MolecularWeight: 247.677

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Descriptors Computed from Structure

Canonical SMILES:

C#CCCCN1C(=O)C2=C(C1=O)C(=CC=C2)Cl

Isomeric SMILES

C#CCCCN1C(=O)C2=C(C1=O)C(=CC=C2)Cl

InChI

InChI=1S/C13H10ClNO2/c1-2-3-4-8-15-12(16)9-6-5-7-10(14)11(9)13(15)17/h1,5-7H,3-4,8H2