[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate

Systemtic Name: [2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 3-chloranyl-5-ethoxy-4-oxidanyl-benzoate Openeye Name: [2-(4-cyclohexylphenyl)-2-oxo-ethyl] 3-chloro-5-ethoxy-4-hydroxy-benzoate CAS Name: 3-chloro-5-ethoxy-4-hydroxybenzoic acid [2-(4-cyclohexylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-cyclohexylphenyl)-2-oxoethyl] 3-chloro-5-ethoxy-4-hydroxybenzoate Traditional Name: 3-chloro-5-ethoxy-4-hydroxy-benzoic acid [2-(4-cyclohexylphenyl)-2-keto-ethyl] ester Formula: C23H25ClO5 MolecularWeight: 416.8946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3CCCCC3)Cl)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)C3CCCCC3)Cl)O

InChI

InChI=1S/C23H25ClO5/c1-2-28-21-13-18(12-19(24)22(21)26)23(27)29-14-20(25)17-10-8-16(9-11-17)15-6-4-3-5-7-15/h8-13,15,26H,2-7,14H2,1H3