3,3-bis(3-chloranyl-4-methoxy-5-methoxycarbonyl-phenyl)prop-2-enoic acid

Systemtic Name: 3,3-bis(3-chloranyl-4-methoxy-5-methoxycarbonyl-phenyl)prop-2-enoic acid Openeye Name: 3,3-bis(3-chloro-4-methoxy-5-methoxycarbonyl-phenyl)prop-2-enoic acid CAS Name: 3,3-bis(3-chloro-4-methoxy-5-methoxycarbonylphenyl)-2-propenoic acid IUPAC Name: 3,3-bis(3-chloro-4-methoxy-5-methoxycarbonylphenyl)prop-2-enoic acid Traditional Name: 3,3-bis(3-carbomethoxy-5-chloro-4-methoxy-phenyl)acrylic acid Formula: C21H18Cl2O8 MolecularWeight: 469.26882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=CC(=O)O)C2=CC(=C(C(=C2)Cl)OC)C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=CC(=O)O)C2=CC(=C(C(=C2)Cl)OC)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H18Cl2O8/c1-28-18-13(20(26)30-3)5-10(7-15(18)22)12(9-17(24)25)11-6-14(21(27)31-4)19(29-2)16(23)8-11/h5-9H,1-4H3,(H,24,25)