[3-(acetyloxymethyl)-5-(4-heptoxyphenyl)-3-(methoxycarbonylamino)pentyl] ethanoate

Systemtic Name: [3-(acetyloxymethyl)-5-(4-heptoxyphenyl)-3-(methoxycarbonylamino)pentyl] ethanoate Openeye Name: [3-(acetoxymethyl)-5-(4-heptoxyphenyl)-3-(methoxycarbonylamino)pentyl] acetate CAS Name: acetic acid [3-(acetyloxymethyl)-5-(4-heptoxyphenyl)-3-(methoxycarbonylamino)pentyl] ester IUPAC Name: [3-(acetyloxymethyl)-5-(4-heptoxyphenyl)-3-(methoxycarbonylamino)pentyl] acetate Traditional Name: acetic acid [3-(acetoxymethyl)-3-(carbomethoxyamino)-5-(4-heptoxyphenyl)pentyl] ester Formula: C25H39NO7 MolecularWeight: 465.57966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CCC(CCOC(=O)C)(COC(=O)C)NC(=O)OC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CCC(CCOC(=O)C)(COC(=O)C)NC(=O)OC

InChI

InChI=1S/C25H39NO7/c1-5-6-7-8-9-17-32-23-12-10-22(11-13-23)14-15-25(19-33-21(3)28,26-24(29)30-4)16-18-31-20(2)27/h10-13H,5-9,14-19H2,1-4H3,(H,26,29)