ethyl 2-[4-[6-(3-hexoxyphenoxy)hexanoylamino]-1-methyl-piperidin-4-yl]ethanoate

Systemtic Name: ethyl 2-[4-[6-(3-hexoxyphenoxy)hexanoylamino]-1-methyl-piperidin-4-yl]ethanoate Openeye Name: ethyl 2-[4-[6-(3-hexoxyphenoxy)hexanoylamino]-1-methyl-4-piperidyl]acetate CAS Name: 2-[4-[[6-(3-hexoxyphenoxy)-1-oxohexyl]amino]-1-methyl-4-piperidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[6-(3-hexoxyphenoxy)hexanoylamino]-1-methylpiperidin-4-yl]acetate Traditional Name: 2-[4-[6-(3-hexoxyphenoxy)hexanoylamino]-1-methyl-4-piperidyl]acetic acid ethyl ester Formula: C28H46N2O5 MolecularWeight: 490.67524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)OCCCCCC(=O)NC2(CCN(CC2)C)CC(=O)OCC

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)OCCCCCC(=O)NC2(CCN(CC2)C)CC(=O)OCC

InChI

InChI=1S/C28H46N2O5/c1-4-6-7-10-20-34-24-13-12-14-25(22-24)35-21-11-8-9-15-26(31)29-28(23-27(32)33-5-2)16-18-30(3)19-17-28/h12-14,22H,4-11,15-21,23H2,1-3H3,(H,29,31)