[2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-(4-bromanyl-3-methyl-phenoxy)ethanoate

Systemtic Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-(4-bromanyl-3-methyl-phenoxy)ethanoate Openeye Name: [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] 2-(4-bromo-3-methyl-phenoxy)acetate CAS Name: 2-(4-bromo-3-methylphenoxy)acetic acid [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-(4-bromo-3-methylphenoxy)acetate Traditional Name: 2-(4-bromo-3-methyl-phenoxy)acetic acid [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C18H16BrNO6 MolecularWeight: 422.22674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OC2=C(C=C(C=C2)C=C[N+](=O)[O-])OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OC2=C(C=C(C=C2)/C=C/[N+](=O)[O-])OC)Br

InChI

InChI=1S/C18H16BrNO6/c1-12-9-14(4-5-15(12)19)25-11-18(21)26-16-6-3-13(7-8-20(22)23)10-17(16)24-2/h3-10H,11H2,1-2H3/b8-7+