methyl (E)-3-[(2S,4S)-7-iodanyl-2-methyl-1-phenylmethoxy-heptan-4-yl]oxyprop-2-enoate

Systemtic Name: methyl (E)-3-[(2S,4S)-7-iodanyl-2-methyl-1-phenylmethoxy-heptan-4-yl]oxyprop-2-enoate Openeye Name: methyl (E)-3-[(1S,3S)-4-benzyloxy-1-(3-iodopropyl)-3-methyl-butoxy]prop-2-enoate CAS Name: (E)-3-[(2S,4S)-7-iodo-2-methyl-1-phenylmethoxyheptan-4-yl]oxy-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[(2S,4S)-7-iodo-2-methyl-1-phenylmethoxyheptan-4-yl]oxyprop-2-enoate Traditional Name: (E)-3-[(1S,3S)-4-benzoxy-1-(3-iodopropyl)-3-methyl-butoxy]acrylic acid methyl ester Formula: C19H27IO4 MolecularWeight: 446.31975

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CCCI)OC=CC(=O)OC)COCC1=CC=CC=C1

Isomeric SMILES

C[C@@H](C[C@H](CCCI)O/C=C/C(=O)OC)COCC1=CC=CC=C1

InChI

InChI=1S/C19H27IO4/c1-16(14-23-15-17-7-4-3-5-8-17)13-18(9-6-11-20)24-12-10-19(21)22-2/h3-5,7-8,10,12,16,18H,6,9,11,13-15H2,1-2H3/b12-10+/t16-,18-/m0/s1