[4-acetyloxy-3-(4-cyano-3-oxidanyl-butyl)-2,5,6-trimethyl-phenyl] ethanoate

Systemtic Name: [4-acetyloxy-3-(4-cyano-3-oxidanyl-butyl)-2,5,6-trimethyl-phenyl] ethanoate Openeye Name: [4-acetoxy-3-(4-cyano-3-hydroxy-butyl)-2,5,6-trimethyl-phenyl] acetate CAS Name: acetic acid [4-acetyloxy-3-(4-cyano-3-hydroxybutyl)-2,5,6-trimethylphenyl] ester IUPAC Name: [4-acetyloxy-3-(4-cyano-3-hydroxybutyl)-2,5,6-trimethylphenyl] acetate Traditional Name: acetic acid [4-acetoxy-3-(4-cyano-3-hydroxy-butyl)-2,5,6-trimethyl-phenyl] ester Formula: C18H23NO5 MolecularWeight: 333.37892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1OC(=O)C)C)CCC(CC#N)O)OC(=O)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1OC(=O)C)C)CCC(CC#N)O)OC(=O)C)C

InChI

InChI=1S/C18H23NO5/c1-10-11(2)18(24-14(5)21)16(7-6-15(22)8-9-19)12(3)17(10)23-13(4)20/h15,22H,6-8H2,1-5H3