2-[4-[2-(chloromethyl)-4-nitro-phenoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[2-(chloromethyl)-4-nitro-phenoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[2-(chloromethyl)-4-nitro-phenoxy]phenyl]acetonitrile CAS Name: 2-[4-[2-(chloromethyl)-4-nitrophenoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[2-(chloromethyl)-4-nitrophenoxy]phenyl]acetonitrile Traditional Name: 2-[4-[2-(chloromethyl)-4-nitro-phenoxy]phenyl]acetonitrile Formula: C15H11ClN2O3 MolecularWeight: 302.71244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)OC2=C(C=C(C=C2)[N+](=O)[O-])CCl

Isomeric SMILES

C1=CC(=CC=C1CC#N)OC2=C(C=C(C=C2)[N+](=O)[O-])CCl

InChI

InChI=1S/C15H11ClN2O3/c16-10-12-9-13(18(19)20)3-6-15(12)21-14-4-1-11(2-5-14)7-8-17/h1-6,9H,7,10H2