6-[(3-chloranyl-4-methoxy-phenyl)-oxidanyl-methyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(3-chloranyl-4-methoxy-phenyl)-oxidanyl-methyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(3-chloro-4-methoxy-phenyl)-hydroxy-methyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[(3-chloro-4-methoxyphenyl)-hydroxymethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(3-chloro-4-methoxyphenyl)-hydroxymethyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(3-chloro-4-methoxy-phenyl)-hydroxy-methyl]cyclohex-3-ene-1-carboxylic acid Formula: C15H17ClO4 MolecularWeight: 296.74608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2CC=CCC2C(=O)O)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2CC=CCC2C(=O)O)O)Cl

InChI

InChI=1S/C15H17ClO4/c1-20-13-7-6-9(8-12(13)16)14(17)10-4-2-3-5-11(10)15(18)19/h2-3,6-8,10-11,14,17H,4-5H2,1H3,(H,18,19)