methyl (E,5R,6S)-6-(5-bromanyl-1,3-benzodioxol-4-yl)-6-methoxy-5-methyl-hex-3-enoate

Systemtic Name: methyl (E,5R,6S)-6-(5-bromanyl-1,3-benzodioxol-4-yl)-6-methoxy-5-methyl-hex-3-enoate Openeye Name: methyl (E,5R,6S)-6-(5-bromo-1,3-benzodioxol-4-yl)-6-methoxy-5-methyl-hex-3-enoate CAS Name: (E,5R,6S)-6-(5-bromo-1,3-benzodioxol-4-yl)-6-methoxy-5-methyl-3-hexenoic acid methyl ester IUPAC Name: methyl (E,5R,6S)-6-(5-bromo-1,3-benzodioxol-4-yl)-6-methoxy-5-methylhex-3-enoate Traditional Name: (E,5R,6S)-6-(5-bromo-1,3-benzodioxol-4-yl)-6-methoxy-5-methyl-hex-3-enoic acid methyl ester Formula: C16H19BrO5 MolecularWeight: 371.22306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CCC(=O)OC)C(C1=C(C=CC2=C1OCO2)Br)OC

Isomeric SMILES

C[C@H](/C=C/CC(=O)OC)[C@@H](C1=C(C=CC2=C1OCO2)Br)OC

InChI

InChI=1S/C16H19BrO5/c1-10(5-4-6-13(18)19-2)15(20-3)14-11(17)7-8-12-16(14)22-9-21-12/h4-5,7-8,10,15H,6,9H2,1-3H3/b5-4+/t10-,15+/m1/s1