methyl 2-[6-(2-bromanyl-3-methanoyl-6-methoxy-phenoxy)cyclohexen-1-yl]ethanoate

Systemtic Name: methyl 2-[6-(2-bromanyl-3-methanoyl-6-methoxy-phenoxy)cyclohexen-1-yl]ethanoate Openeye Name: methyl 2-[6-(2-bromo-3-formyl-6-methoxy-phenoxy)cyclohexen-1-yl]acetate CAS Name: 2-[6-(2-bromo-3-formyl-6-methoxyphenoxy)-1-cyclohexenyl]acetic acid methyl ester IUPAC Name: methyl 2-[6-(2-bromo-3-formyl-6-methoxyphenoxy)cyclohexen-1-yl]acetate Traditional Name: 2-[6-(2-bromo-3-formyl-6-methoxy-phenoxy)cyclohexen-1-yl]acetic acid methyl ester Formula: C17H19BrO5 MolecularWeight: 383.23376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C=O)Br)OC2CCCC=C2CC(=O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C=O)Br)OC2CCCC=C2CC(=O)OC

InChI

InChI=1S/C17H19BrO5/c1-21-14-8-7-12(10-19)16(18)17(14)23-13-6-4-3-5-11(13)9-15(20)22-2/h5,7-8,10,13H,3-4,6,9H2,1-2H3