2-[6-(2-methylpropyl)-4-oxidanyl-1,3-bis(oxidanylidene)-5-prop-2-enyl-isoindol-2-yl]ethanenitrile

Systemtic Name: 2-[6-(2-methylpropyl)-4-oxidanyl-1,3-bis(oxidanylidene)-5-prop-2-enyl-isoindol-2-yl]ethanenitrile Openeye Name: 2-(5-allyl-4-hydroxy-6-isobutyl-1,3-dioxo-isoindolin-2-yl)acetonitrile CAS Name: 2-[4-hydroxy-6-(2-methylpropyl)-1,3-dioxo-5-prop-2-enyl-2-isoindolyl]acetonitrile IUPAC Name: 2-[4-hydroxy-6-(2-methylpropyl)-1,3-dioxo-5-prop-2-enylisoindol-2-yl]acetonitrile Traditional Name: 2-(5-allyl-4-hydroxy-6-isobutyl-1,3-diketo-isoindolin-2-yl)acetonitrile Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=C2C(=C1)C(=O)N(C2=O)CC#N)O)CC=C

Isomeric SMILES

CC(C)CC1=C(C(=C2C(=C1)C(=O)N(C2=O)CC#N)O)CC=C

InChI

InChI=1S/C17H18N2O3/c1-4-5-12-11(8-10(2)3)9-13-14(15(12)20)17(22)19(7-6-18)16(13)21/h4,9-10,20H,1,5,7-8H2,2-3H3