2-[(2-chloranyl-5-methoxy-phenyl)methyl]butanedioic acid

Systemtic Name: 2-[(2-chloranyl-5-methoxy-phenyl)methyl]butanedioic acid Openeye Name: 2-[(2-chloro-5-methoxy-phenyl)methyl]butanedioic acid CAS Name: 2-[(2-chloro-5-methoxyphenyl)methyl]butanedioic acid IUPAC Name: 2-[(2-chloro-5-methoxyphenyl)methyl]butanedioic acid Traditional Name: 2-(2-chloro-5-methoxy-benzyl)succinic acid Formula: C12H13ClO5 MolecularWeight: 272.68162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)CC(CC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)CC(CC(=O)O)C(=O)O

InChI

InChI=1S/C12H13ClO5/c1-18-9-2-3-10(13)7(5-9)4-8(12(16)17)6-11(14)15/h2-3,5,8H,4,6H2,1H3,(H,14,15)(H,16,17)