[2-bromanyl-6-methoxy-4-(2-nitroethenyl)phenyl] 2-(4-tert-butylphenoxy)ethanoate

Systemtic Name: [2-bromanyl-6-methoxy-4-(2-nitroethenyl)phenyl] 2-(4-tert-butylphenoxy)ethanoate Openeye Name: [2-bromo-6-methoxy-4-(2-nitrovinyl)phenyl] 2-(4-tert-butylphenoxy)acetate CAS Name: 2-(4-tert-butylphenoxy)acetic acid [2-bromo-6-methoxy-4-(2-nitroethenyl)phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-(2-nitroethenyl)phenyl] 2-(4-tert-butylphenoxy)acetate Traditional Name: 2-(4-tert-butylphenoxy)acetic acid [2-bromo-6-methoxy-4-(2-nitrovinyl)phenyl] ester Formula: C21H22BrNO6 MolecularWeight: 464.30648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)OC2=C(C=C(C=C2Br)C=C[N+](=O)[O-])OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)OC2=C(C=C(C=C2Br)C=C[N+](=O)[O-])OC

InChI

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