2-[5-[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]-2-methoxy-phenyl]ethanoate

Systemtic Name: 2-[5-[(E)-3-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)prop-2-enoyl]-2-methoxy-phenyl]ethanoate Openeye Name: 2-[5-[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)prop-2-enoyl]-2-methoxy-phenyl]acetate CAS Name: 2-[5-[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)-1-oxoprop-2-enyl]-2-methoxyphenyl]acetate IUPAC Name: 2-[5-[(E)-3-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)prop-2-enoyl]-2-methoxyphenyl]acetate Traditional Name: 2-[5-[(E)-3-(3-chloro-4-isopropoxy-5-methoxy-phenyl)acryloyl]-2-methoxy-phenyl]acetate Formula: C22H22ClO6- MolecularWeight: 417.85948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Cl)C=CC(=O)C2=CC(=C(C=C2)OC)CC(=O)[O-])OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Cl)/C=C/C(=O)C2=CC(=C(C=C2)OC)CC(=O)[O-])OC

InChI

InChI=1S/C22H23ClO6/c1-13(2)29-22-17(23)9-14(10-20(22)28-4)5-7-18(24)15-6-8-19(27-3)16(11-15)12-21(25)26/h5-11,13H,12H2,1-4H3,(H,25,26)/p-1/b7-5+