[2,6-di(propan-2-yl)phenyl] 4-[2-(4-ethylpiperazin-1-yl)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: [2,6-di(propan-2-yl)phenyl] 4-[2-(4-ethylpiperazin-1-yl)ethylamino]-4-oxidanylidene-butanoate Openeye Name: (2,6-diisopropylphenyl) 4-[2-(4-ethylpiperazin-1-yl)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(4-ethyl-1-piperazinyl)ethylamino]-4-oxobutanoic acid [2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [2,6-di(propan-2-yl)phenyl] 4-[2-(4-ethylpiperazin-1-yl)ethylamino]-4-oxobutanoate Traditional Name: 4-[2-(4-ethylpiperazino)ethylamino]-4-keto-butyric acid (2,6-diisopropylphenyl) ester Formula: C24H39N3O3 MolecularWeight: 417.58476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCNC(=O)CCC(=O)OC2=C(C=CC=C2C(C)C)C(C)C

Isomeric SMILES

CCN1CCN(CC1)CCNC(=O)CCC(=O)OC2=C(C=CC=C2C(C)C)C(C)C

InChI

InChI=1S/C24H39N3O3/c1-6-26-14-16-27(17-15-26)13-12-25-22(28)10-11-23(29)30-24-20(18(2)3)8-7-9-21(24)19(4)5/h7-9,18-19H,6,10-17H2,1-5H3,(H,25,28)