5,6-bis(chloranyl)-2-(3-methylidene-2-oxidanylidene-heptan-4-yl)isoindole-1,3-dione

Systemtic Name: 5,6-bis(chloranyl)-2-(3-methylidene-2-oxidanylidene-heptan-4-yl)isoindole-1,3-dione Openeye Name: 5,6-dichloro-2-(2-methylene-3-oxo-1-propyl-butyl)isoindoline-1,3-dione CAS Name: 5,6-dichloro-2-(3-methylene-2-oxoheptan-4-yl)isoindole-1,3-dione IUPAC Name: 5,6-dichloro-2-(3-methylidene-2-oxoheptan-4-yl)isoindole-1,3-dione Traditional Name: 2-(2-acetyl-1-propyl-allyl)-5,6-dichloro-isoindoline-1,3-quinone Formula: C16H15Cl2NO3 MolecularWeight: 340.2012

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=C)C(=O)C)N1C(=O)C2=CC(=C(C=C2C1=O)Cl)Cl

Isomeric SMILES

CCCC(C(=C)C(=O)C)N1C(=O)C2=CC(=C(C=C2C1=O)Cl)Cl

InChI

InChI=1S/C16H15Cl2NO3/c1-4-5-14(8(2)9(3)20)19-15(21)10-6-12(17)13(18)7-11(10)16(19)22/h6-7,14H,2,4-5H2,1,3H3