butyl 3,4-dibutyl-2-chloranyl-benzoate

Systemtic Name: butyl 3,4-dibutyl-2-chloranyl-benzoate Openeye Name: butyl 3,4-dibutyl-2-chloro-benzoate CAS Name: 3,4-dibutyl-2-chlorobenzoic acid butyl ester IUPAC Name: butyl 3,4-dibutyl-2-chlorobenzoate Traditional Name: 3,4-dibutyl-2-chloro-benzoic acid butyl ester Formula: C19H29ClO2 MolecularWeight: 324.88536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C=C1)C(=O)OCCCC)Cl)CCCC

Isomeric SMILES

CCCCC1=C(C(=C(C=C1)C(=O)OCCCC)Cl)CCCC

InChI

InChI=1S/C19H29ClO2/c1-4-7-10-15-12-13-17(19(21)22-14-9-6-3)18(20)16(15)11-8-5-2/h12-13H,4-11,14H2,1-3H3