4-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]butanal

Systemtic Name: 4-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]butanal Openeye Name: 4-[3-(4-chlorobenzoyl)-2-methyl-phenyl]butanal CAS Name: 4-[3-[(4-chlorophenyl)-oxomethyl]-2-methylphenyl]butanal IUPAC Name: 4-[3-(4-chlorobenzoyl)-2-methylphenyl]butanal Traditional Name: 4-[3-(4-chlorobenzoyl)-2-methyl-phenyl]butyraldehyde Formula: C18H17ClO2 MolecularWeight: 300.77938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1CCCC=O)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C=CC=C1CCCC=O)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H17ClO2/c1-13-14(5-2-3-12-20)6-4-7-17(13)18(21)15-8-10-16(19)11-9-15/h4,6-12H,2-3,5H2,1H3