[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl] 4-methylpentanoate

Systemtic Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl] 4-methylpentanoate Openeye Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl] 4-methylpentanoate CAS Name: 4-methylpentanoic acid [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl] 4-methylpentanoate Traditional Name: 4-methylvaleric acid [2-(homoveratrylamino)-2-keto-ethyl] ester Formula: C18H27NO5 MolecularWeight: 337.41068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)OCC(=O)NCCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(C)CCC(=O)OCC(=O)NCCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C18H27NO5/c1-13(2)5-8-18(21)24-12-17(20)19-10-9-14-6-7-15(22-3)16(11-14)23-4/h6-7,11,13H,5,8-10,12H2,1-4H3,(H,19,20)