(E)-3-ethoxy-3-oxidanyl-2-[3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]prop-2-enenitrile

Systemtic Name: (E)-3-ethoxy-3-oxidanyl-2-[3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]prop-2-enenitrile Openeye Name: (E)-2-(2-benzyl-3-oxo-isoindolin-1-yl)-3-ethoxy-3-hydroxy-prop-2-enenitrile CAS Name: (E)-3-ethoxy-3-hydroxy-2-[3-oxo-2-(phenylmethyl)-1H-isoindol-1-yl]-2-propenenitrile IUPAC Name: (E)-2-(2-benzyl-3-oxo-1H-isoindol-1-yl)-3-ethoxy-3-hydroxyprop-2-enenitrile Traditional Name: (E)-2-(2-benzyl-3-keto-isoindolin-1-yl)-3-ethoxy-3-hydroxy-acrylonitrile Formula: C20H18N2O3 MolecularWeight: 334.36852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C1C2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)O

Isomeric SMILES

CCO/C(=C(/C#N)\C1C2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)/O

InChI

InChI=1S/C20H18N2O3/c1-2-25-20(24)17(12-21)18-15-10-6-7-11-16(15)19(23)22(18)13-14-8-4-3-5-9-14/h3-11,18,24H,2,13H2,1H3/b20-17-