pentyl 3-(2-chloranyl-6-methyl-phenyl)-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: pentyl 3-(2-chloranyl-6-methyl-phenyl)-3-oxidanylidene-2-phenyl-propanoate Openeye Name: pentyl 3-(2-chloro-6-methyl-phenyl)-3-oxo-2-phenyl-propanoate CAS Name: 3-(2-chloro-6-methylphenyl)-3-oxo-2-phenylpropanoic acid pentyl ester IUPAC Name: pentyl 3-(2-chloro-6-methylphenyl)-3-oxo-2-phenylpropanoate Traditional Name: 3-(2-chloro-6-methyl-phenyl)-3-keto-2-phenyl-propionic acid amyl ester Formula: C21H23ClO3 MolecularWeight: 358.85852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(C1=CC=CC=C1)C(=O)C2=C(C=CC=C2Cl)C

Isomeric SMILES

CCCCCOC(=O)C(C1=CC=CC=C1)C(=O)C2=C(C=CC=C2Cl)C

InChI

InChI=1S/C21H23ClO3/c1-3-4-8-14-25-21(24)19(16-11-6-5-7-12-16)20(23)18-15(2)10-9-13-17(18)22/h5-7,9-13,19H,3-4,8,14H2,1-2H3