[cyano-(3-phenoxyphenyl)methyl] 5,5-bis(bromanyl)-3-methyl-2-propan-2-yl-pent-4-enoate

Systemtic Name: [cyano-(3-phenoxyphenyl)methyl] 5,5-bis(bromanyl)-3-methyl-2-propan-2-yl-pent-4-enoate Openeye Name: [cyano-(3-phenoxyphenyl)methyl] 5,5-dibromo-2-isopropyl-3-methyl-pent-4-enoate CAS Name: 5,5-dibromo-3-methyl-2-propan-2-yl-4-pentenoic acid [cyano-(3-phenoxyphenyl)methyl] ester IUPAC Name: [cyano-(3-phenoxyphenyl)methyl] 5,5-dibromo-3-methyl-2-propan-2-ylpent-4-enoate Traditional Name: 5,5-dibromo-2-isopropyl-3-methyl-pent-4-enoic acid [cyano-(3-phenoxyphenyl)methyl] ester Formula: C23H23Br2NO3 MolecularWeight: 521.24162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C=C(Br)Br)C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(C)C=C(Br)Br)C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C23H23Br2NO3/c1-15(2)22(16(3)12-21(24)25)23(27)29-20(14-26)17-8-7-11-19(13-17)28-18-9-5-4-6-10-18/h4-13,15-16,20,22H,1-3H3