(E,3R)-7-chloranyl-3-(3,4-dimethoxyphenyl)-6-methyl-hept-6-enoic acid

Systemtic Name: (E,3R)-7-chloranyl-3-(3,4-dimethoxyphenyl)-6-methyl-hept-6-enoic acid Openeye Name: (E,3R)-7-chloro-3-(3,4-dimethoxyphenyl)-6-methyl-hept-6-enoic acid CAS Name: (E,3R)-7-chloro-3-(3,4-dimethoxyphenyl)-6-methyl-6-heptenoic acid IUPAC Name: (E,3R)-7-chloro-3-(3,4-dimethoxyphenyl)-6-methylhept-6-enoic acid Traditional Name: (E,3R)-7-chloro-3-(3,4-dimethoxyphenyl)-6-methyl-hept-6-enoic acid Formula: C16H21ClO4 MolecularWeight: 312.78854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCl)CCC(CC(=O)O)C1=CC(=C(C=C1)OC)OC

Isomeric SMILES

C/C(=C\Cl)/CC[C@H](CC(=O)O)C1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C16H21ClO4/c1-11(10-17)4-5-13(9-16(18)19)12-6-7-14(20-2)15(8-12)21-3/h6-8,10,13H,4-5,9H2,1-3H3,(H,18,19)/b11-10+/t13-/m1/s1