(E)-4-(4-chlorophenyl)-3-methoxycarbonyl-but-3-enoic acid

Systemtic Name: (E)-4-(4-chlorophenyl)-3-methoxycarbonyl-but-3-enoic acid Openeye Name: (E)-4-(4-chlorophenyl)-3-methoxycarbonyl-but-3-enoic acid CAS Name: (E)-4-(4-chlorophenyl)-3-methoxycarbonyl-3-butenoic acid IUPAC Name: (E)-4-(4-chlorophenyl)-3-methoxycarbonylbut-3-enoic acid Traditional Name: (E)-3-carbomethoxy-4-(4-chlorophenyl)but-3-enoic acid Formula: C12H11ClO4 MolecularWeight: 254.66634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=C(C=C1)Cl)CC(=O)O

Isomeric SMILES

COC(=O)/C(=C/C1=CC=C(C=C1)Cl)/CC(=O)O

InChI

InChI=1S/C12H11ClO4/c1-17-12(16)9(7-11(14)15)6-8-2-4-10(13)5-3-8/h2-6H,7H2,1H3,(H,14,15)/b9-6+