5-(4-methoxyphenyl)-3-(phenylmethoxycarbonylamino)hexanoate

Systemtic Name: 5-(4-methoxyphenyl)-3-(phenylmethoxycarbonylamino)hexanoate Openeye Name: 3-(benzyloxycarbonylamino)-5-(4-methoxyphenyl)hexanoate CAS Name: 5-(4-methoxyphenyl)-3-(phenylmethoxycarbonylamino)hexanoate IUPAC Name: 5-(4-methoxyphenyl)-3-(phenylmethoxycarbonylamino)hexanoate Traditional Name: 3-(benzyloxycarbonylamino)-5-(4-methoxyphenyl)hexanoate Formula: C21H24NO5- MolecularWeight: 370.41896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CC(=O)[O-])NC(=O)OCC1=CC=CC=C1)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(CC(CC(=O)[O-])NC(=O)OCC1=CC=CC=C1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H25NO5/c1-15(17-8-10-19(26-2)11-9-17)12-18(13-20(23)24)22-21(25)27-14-16-6-4-3-5-7-16/h3-11,15,18H,12-14H2,1-2H3,(H,22,25)(H,23,24)/p-1