4-[(1-oxidanylidene-2,3-dihydroisoindol-5-yl)oxymethyl]benzenecarbonitrile

Systemtic Name: 4-[(1-oxidanylidene-2,3-dihydroisoindol-5-yl)oxymethyl]benzenecarbonitrile Openeye Name: 4-[(1-oxoisoindolin-5-yl)oxymethyl]benzonitrile CAS Name: 4-[(1-oxo-2,3-dihydroisoindol-5-yl)oxymethyl]benzonitrile IUPAC Name: 4-[(1-oxo-2,3-dihydroisoindol-5-yl)oxymethyl]benzonitrile Traditional Name: 4-[(1-ketoisoindolin-5-yl)oxymethyl]benzonitrile Formula: C16H12N2O2 MolecularWeight: 264.27868

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)OCC3=CC=C(C=C3)C#N)C(=O)N1

Isomeric SMILES

C1C2=C(C=CC(=C2)OCC3=CC=C(C=C3)C#N)C(=O)N1

InChI

InChI=1S/C16H12N2O2/c17-8-11-1-3-12(4-2-11)10-20-14-5-6-15-13(7-14)9-18-16(15)19/h1-7H,9-10H2,(H,18,19)