2-[[5-bromanyl-2-methoxy-4-[(E)-2-nitroethenyl]phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[5-bromanyl-2-methoxy-4-[(E)-2-nitroethenyl]phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[5-bromo-2-methoxy-4-[(E)-2-nitrovinyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[5-bromo-2-methoxy-4-[(E)-2-nitroethenyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[5-bromo-2-methoxy-4-[(E)-2-nitroethenyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[5-bromo-2-methoxy-4-[(E)-2-nitrovinyl]phenoxy]methyl]benzonitrile Formula: C17H13BrN2O4 MolecularWeight: 389.20012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C[N+](=O)[O-])Br)OCC2=CC=CC=C2C#N

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C/[N+](=O)[O-])Br)OCC2=CC=CC=C2C#N

InChI

InChI=1S/C17H13BrN2O4/c1-23-16-8-12(6-7-20(21)22)15(18)9-17(16)24-11-14-5-3-2-4-13(14)10-19/h2-9H,11H2,1H3/b7-6+