(phenylmethyl) 3-[4-(4-phenoxyphenoxy)butylamino]propanoate

Systemtic Name: (phenylmethyl) 3-[4-(4-phenoxyphenoxy)butylamino]propanoate Openeye Name: benzyl 3-[4-(4-phenoxyphenoxy)butylamino]propanoate CAS Name: 3-[4-(4-phenoxyphenoxy)butylamino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[4-(4-phenoxyphenoxy)butylamino]propanoate Traditional Name: 3-[4-(4-phenoxyphenoxy)butylamino]propionic acid benzyl ester Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCNCCCCOC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCNCCCCOC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H29NO4/c28-26(30-21-22-9-3-1-4-10-22)17-19-27-18-7-8-20-29-23-13-15-25(16-14-23)31-24-11-5-2-6-12-24/h1-6,9-16,27H,7-8,17-21H2