[2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanoate

Systemtic Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanoate Openeye Name: [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetate CAS Name: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)acetic acid [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)acetate Traditional Name: 2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetic acid [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C21H22BrNO6 MolecularWeight: 464.30648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)OC2=C(C=C(C=C2)C=C[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)OC2=C(C=C(C=C2)/C=C/[N+](=O)[O-])OC

InChI

InChI=1S/C21H22BrNO6/c1-13(2)16-11-17(22)14(3)9-19(16)28-12-21(24)29-18-6-5-15(7-8-23(25)26)10-20(18)27-4/h5-11,13H,12H2,1-4H3/b8-7+