furan-3-ylmethyl 4,6,6-tris(bromanyl)-3,3-dimethyl-5-(phenylmethyl)hex-5-enoate

Systemtic Name: furan-3-ylmethyl 4,6,6-tris(bromanyl)-3,3-dimethyl-5-(phenylmethyl)hex-5-enoate Openeye Name: 3-furylmethyl 5-benzyl-4,6,6-tribromo-3,3-dimethyl-hex-5-enoate CAS Name: 4,6,6-tribromo-3,3-dimethyl-5-(phenylmethyl)-5-hexenoic acid 3-furanylmethyl ester IUPAC Name: furan-3-ylmethyl 5-benzyl-4,6,6-tribromo-3,3-dimethylhex-5-enoate Traditional Name: 5-benzyl-4,6,6-tribromo-3,3-dimethyl-hex-5-enoic acid 3-furfuryl ester Formula: C20H21Br3O3 MolecularWeight: 549.09094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)OCC1=COC=C1)C(C(=C(Br)Br)CC2=CC=CC=C2)Br

Isomeric SMILES

CC(C)(CC(=O)OCC1=COC=C1)C(C(=C(Br)Br)CC2=CC=CC=C2)Br

InChI

InChI=1S/C20H21Br3O3/c1-20(2,11-17(24)26-13-15-8-9-25-12-15)18(21)16(19(22)23)10-14-6-4-3-5-7-14/h3-9,12,18H,10-11,13H2,1-2H3