2-[3-[4-(4-chlorophenyl)butoxy]propyl]oxirane-2-carboxylic acid

Systemtic Name: 2-[3-[4-(4-chlorophenyl)butoxy]propyl]oxirane-2-carboxylic acid Openeye Name: 2-[3-[4-(4-chlorophenyl)butoxy]propyl]oxirane-2-carboxylic acid CAS Name: 2-[3-[4-(4-chlorophenyl)butoxy]propyl]-2-oxiranecarboxylic acid IUPAC Name: 2-[3-[4-(4-chlorophenyl)butoxy]propyl]oxirane-2-carboxylic acid Traditional Name: 2-[3-[4-(4-chlorophenyl)butoxy]propyl]oxirane-2-carboxylic acid Formula: C16H21ClO4 MolecularWeight: 312.78854

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)(CCCOCCCCC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1C(O1)(CCCOCCCCC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C16H21ClO4/c17-14-7-5-13(6-8-14)4-1-2-10-20-11-3-9-16(12-21-16)15(18)19/h5-8H,1-4,9-12H2,(H,18,19)