2-diethylaminoethyl 3-[4-[6-(diethylamino)hexyl]phenyl]propanoate

Systemtic Name: 2-diethylaminoethyl 3-[4-[6-(diethylamino)hexyl]phenyl]propanoate Openeye Name: 2-diethylaminoethyl 3-[4-[6-(diethylamino)hexyl]phenyl]propanoate CAS Name: 3-[4-[6-(diethylamino)hexyl]phenyl]propanoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 3-[4-[6-(diethylamino)hexyl]phenyl]propanoate Traditional Name: 3-[4-[6-(diethylamino)hexyl]phenyl]propionic acid 2-diethylaminoethyl ester Formula: C25H44N2O2 MolecularWeight: 404.62906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCCCC1=CC=C(C=C1)CCC(=O)OCCN(CC)CC

Isomeric SMILES

CCN(CC)CCCCCCC1=CC=C(C=C1)CCC(=O)OCCN(CC)CC

InChI

InChI=1S/C25H44N2O2/c1-5-26(6-2)20-12-10-9-11-13-23-14-16-24(17-15-23)18-19-25(28)29-22-21-27(7-3)8-4/h14-17H,5-13,18-22H2,1-4H3