2-[4-(3-chloranyl-4-methyl-phenyl)butyl]oxirane-2-carboxylic acid

Systemtic Name: 2-[4-(3-chloranyl-4-methyl-phenyl)butyl]oxirane-2-carboxylic acid Openeye Name: 2-[4-(3-chloro-4-methyl-phenyl)butyl]oxirane-2-carboxylic acid CAS Name: 2-[4-(3-chloro-4-methylphenyl)butyl]-2-oxiranecarboxylic acid IUPAC Name: 2-[4-(3-chloro-4-methylphenyl)butyl]oxirane-2-carboxylic acid Traditional Name: 2-[4-(3-chloro-4-methyl-phenyl)butyl]oxirane-2-carboxylic acid Formula: C14H17ClO3 MolecularWeight: 268.73598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCCCC2(CO2)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCCCC2(CO2)C(=O)O)Cl

InChI

InChI=1S/C14H17ClO3/c1-10-5-6-11(8-12(10)15)4-2-3-7-14(9-18-14)13(16)17/h5-6,8H,2-4,7,9H2,1H3,(H,16,17)