2-(2-methylnon-4-yn-3-yl)isoindole-1,3-dione

Systemtic Name: 2-(2-methylnon-4-yn-3-yl)isoindole-1,3-dione Openeye Name: 2-(1-isopropylhept-2-ynyl)isoindoline-1,3-dione CAS Name: 2-(2-methylnon-4-yn-3-yl)isoindole-1,3-dione IUPAC Name: 2-(2-methylnon-4-yn-3-yl)isoindole-1,3-dione Traditional Name: 2-(1-isopropylhept-2-ynyl)isoindoline-1,3-quinone Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(C(C)C)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCCCC#CC(C(C)C)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C18H21NO2/c1-4-5-6-7-12-16(13(2)3)19-17(20)14-10-8-9-11-15(14)18(19)21/h8-11,13,16H,4-6H2,1-3H3