2-[3-[(2-methoxy-4-nitro-phenoxy)methyl]phenyl]ethanenitrile

Systemtic Name: 2-[3-[(2-methoxy-4-nitro-phenoxy)methyl]phenyl]ethanenitrile Openeye Name: 2-[3-[(2-methoxy-4-nitro-phenoxy)methyl]phenyl]acetonitrile CAS Name: 2-[3-[(2-methoxy-4-nitrophenoxy)methyl]phenyl]acetonitrile IUPAC Name: 2-[3-[(2-methoxy-4-nitrophenoxy)methyl]phenyl]acetonitrile Traditional Name: 2-[3-[(2-methoxy-4-nitro-phenoxy)methyl]phenyl]acetonitrile Formula: C16H14N2O4 MolecularWeight: 298.29336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])OCC2=CC=CC(=C2)CC#N

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])OCC2=CC=CC(=C2)CC#N

InChI

InChI=1S/C16H14N2O4/c1-21-16-10-14(18(19)20)5-6-15(16)22-11-13-4-2-3-12(9-13)7-8-17/h2-6,9-10H,7,11H2,1H3