[3-chloranyl-4-(8-oxidanylidene-7-propanoyl-decoxy)phenyl] ethanoate

Systemtic Name: [3-chloranyl-4-(8-oxidanylidene-7-propanoyl-decoxy)phenyl] ethanoate Openeye Name: [3-chloro-4-(8-oxo-7-propanoyl-decoxy)phenyl] acetate CAS Name: acetic acid [3-chloro-4-[8-oxo-7-(1-oxopropyl)decoxy]phenyl] ester IUPAC Name: [3-chloro-4-(8-oxo-7-propanoyldecoxy)phenyl] acetate Traditional Name: acetic acid [3-chloro-4-(8-keto-7-propionyl-decoxy)phenyl] ester Formula: C21H29ClO5 MolecularWeight: 396.90496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCCCOC1=C(C=C(C=C1)OC(=O)C)Cl)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCCCOC1=C(C=C(C=C1)OC(=O)C)Cl)C(=O)CC

InChI

InChI=1S/C21H29ClO5/c1-4-19(24)17(20(25)5-2)10-8-6-7-9-13-26-21-12-11-16(14-18(21)22)27-15(3)23/h11-12,14,17H,4-10,13H2,1-3H3