[4-[2-(ethylamino)ethyl]-2-(3-methylbutanoyloxy)phenyl] 3-methylbutanoate

Systemtic Name: [4-[2-(ethylamino)ethyl]-2-(3-methylbutanoyloxy)phenyl] 3-methylbutanoate Openeye Name: [4-[2-(ethylamino)ethyl]-2-(3-methylbutanoyloxy)phenyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [4-[2-(ethylamino)ethyl]-2-(3-methyl-1-oxobutoxy)phenyl] ester IUPAC Name: [4-[2-(ethylamino)ethyl]-2-(3-methylbutanoyloxy)phenyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [4-[2-(ethylamino)ethyl]-2-isovaleryloxy-phenyl] ester Formula: C20H31NO4 MolecularWeight: 349.46444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCCC1=CC(=C(C=C1)OC(=O)CC(C)C)OC(=O)CC(C)C

Isomeric SMILES

CCNCCC1=CC(=C(C=C1)OC(=O)CC(C)C)OC(=O)CC(C)C

InChI

InChI=1S/C20H31NO4/c1-6-21-10-9-16-7-8-17(24-19(22)11-14(2)3)18(13-16)25-20(23)12-15(4)5/h7-8,13-15,21H,6,9-12H2,1-5H3