(E)-3-(4-acetyloxy-3-chloranyl-5-methoxy-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-acetyloxy-3-chloranyl-5-methoxy-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-acetoxy-3-chloro-5-methoxy-phenyl)prop-2-enoic acid CAS Name: (E)-3-(4-acetyloxy-3-chloro-5-methoxyphenyl)-2-propenoic acid IUPAC Name: (E)-3-(4-acetyloxy-3-chloro-5-methoxyphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-acetoxy-3-chloro-5-methoxy-phenyl)acrylic acid Formula: C12H11ClO5 MolecularWeight: 270.66574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1Cl)C=CC(=O)O)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1Cl)/C=C/C(=O)O)OC

InChI

InChI=1S/C12H11ClO5/c1-7(14)18-12-9(13)5-8(3-4-11(15)16)6-10(12)17-2/h3-6H,1-2H3,(H,15,16)/b4-3+