[2-bromanyl-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [2-bromanyl-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] 4-chloranylbenzoate Openeye Name: [2-bromo-6-methoxy-4-[(E)-2-nitrovinyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2-bromo-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-bromo-6-methoxy-4-[(E)-2-nitroethenyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [2-bromo-6-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C16H11BrClNO5 MolecularWeight: 412.61924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C[N+](=O)[O-])Br)OC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/[N+](=O)[O-])Br)OC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H11BrClNO5/c1-23-14-9-10(6-7-19(21)22)8-13(17)15(14)24-16(20)11-2-4-12(18)5-3-11/h2-9H,1H3/b7-6+