7-chloranyl-2-methyl-4-oxidanylidene-2-phenyl-heptanoic acid

Systemtic Name: 7-chloranyl-2-methyl-4-oxidanylidene-2-phenyl-heptanoic acid Openeye Name: 7-chloro-2-methyl-4-oxo-2-phenyl-heptanoic acid CAS Name: 7-chloro-2-methyl-4-oxo-2-phenylheptanoic acid IUPAC Name: 7-chloro-2-methyl-4-oxo-2-phenylheptanoic acid Traditional Name: 7-chloro-4-keto-2-methyl-2-phenyl-enanthic acid Formula: C14H17ClO3 MolecularWeight: 268.73598

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)CCCCl)(C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(CC(=O)CCCCl)(C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C14H17ClO3/c1-14(13(17)18,10-12(16)8-5-9-15)11-6-3-2-4-7-11/h2-4,6-7H,5,8-10H2,1H3,(H,17,18)