2-methylpropyl 2-(3-chloranyl-4-ethanoyl-phenyl)-4-methyl-pentanoate

Systemtic Name: 2-methylpropyl 2-(3-chloranyl-4-ethanoyl-phenyl)-4-methyl-pentanoate Openeye Name: isobutyl 2-(4-acetyl-3-chloro-phenyl)-4-methyl-pentanoate CAS Name: 2-(4-acetyl-3-chlorophenyl)-4-methylpentanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(4-acetyl-3-chlorophenyl)-4-methylpentanoate Traditional Name: 2-(4-acetyl-3-chloro-phenyl)-4-methyl-valeric acid isobutyl ester Formula: C18H25ClO3 MolecularWeight: 324.8423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25ClO3/c1-11(2)8-16(18(21)22-10-12(3)4)14-6-7-15(13(5)20)17(19)9-14/h6-7,9,11-12,16H,8,10H2,1-5H3