(phenylmethyl) 3-[1-(4-phenoxyphenoxy)butylamino]propanoate

Systemtic Name: (phenylmethyl) 3-[1-(4-phenoxyphenoxy)butylamino]propanoate Openeye Name: benzyl 3-[1-(4-phenoxyphenoxy)butylamino]propanoate CAS Name: 3-[1-(4-phenoxyphenoxy)butylamino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[1-(4-phenoxyphenoxy)butylamino]propanoate Traditional Name: 3-[1-(4-phenoxyphenoxy)butylamino]propionic acid benzyl ester Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(NCCC(=O)OCC1=CC=CC=C1)OC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCC(NCCC(=O)OCC1=CC=CC=C1)OC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H29NO4/c1-2-9-25(27-19-18-26(28)29-20-21-10-5-3-6-11-21)31-24-16-14-23(15-17-24)30-22-12-7-4-8-13-22/h3-8,10-17,25,27H,2,9,18-20H2,1H3