4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-chloranyl-benzenecarbonitrile Openeye Name: 3-chloro-4-[(1,3-dioxoisoindolin-2-yl)methyl]benzonitrile CAS Name: 3-chloro-4-[(1,3-dioxo-2-isoindolyl)methyl]benzonitrile IUPAC Name: 3-chloro-4-[(1,3-dioxoisoindol-2-yl)methyl]benzonitrile Traditional Name: 3-chloro-4-(phthalimidomethyl)benzonitrile Formula: C16H9ClN2O2 MolecularWeight: 296.70786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=C(C=C(C=C3)C#N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=C(C=C(C=C3)C#N)Cl

InChI

InChI=1S/C16H9ClN2O2/c17-14-7-10(8-18)5-6-11(14)9-19-15(20)12-3-1-2-4-13(12)16(19)21/h1-7H,9H2