propyl 4-chloranyl-2-propyl-benzoate

Systemtic Name: propyl 4-chloranyl-2-propyl-benzoate Openeye Name: propyl 4-chloro-2-propyl-benzoate CAS Name: 4-chloro-2-propylbenzoic acid propyl ester IUPAC Name: propyl 4-chloro-2-propylbenzoate Traditional Name: 4-chloro-2-propyl-benzoic acid propyl ester Formula: C13H17ClO2 MolecularWeight: 240.72588

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)Cl)C(=O)OCCC

Isomeric SMILES

CCCC1=C(C=CC(=C1)Cl)C(=O)OCCC

InChI

InChI=1S/C13H17ClO2/c1-3-5-10-9-11(14)6-7-12(10)13(15)16-8-4-2/h6-7,9H,3-5,8H2,1-2H3