4-[3-(chloromethyl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[3-(chloromethyl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzenecarbonitrile Openeye Name: 4-[3-(chloromethyl)-2,5-dioxo-pyrrolidin-1-yl]benzonitrile CAS Name: 4-[3-(chloromethyl)-2,5-dioxo-1-pyrrolidinyl]benzonitrile IUPAC Name: 4-[3-(chloromethyl)-2,5-dioxopyrrolidin-1-yl]benzonitrile Traditional Name: 4-[3-(chloromethyl)-2,5-diketo-pyrrolidino]benzonitrile Formula: C12H9ClN2O2 MolecularWeight: 248.66506

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)C#N)CCl

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)C#N)CCl

InChI

InChI=1S/C12H9ClN2O2/c13-6-9-5-11(16)15(12(9)17)10-3-1-8(7-14)2-4-10/h1-4,9H,5-6H2