ethyl 3-(2-azanylpyridin-3-yl)-5-[4-(phenylmethyl)phenoxy]pentanoate

Systemtic Name: ethyl 3-(2-azanylpyridin-3-yl)-5-[4-(phenylmethyl)phenoxy]pentanoate Openeye Name: ethyl 3-(2-amino-3-pyridyl)-5-(4-benzylphenoxy)pentanoate CAS Name: 3-(2-amino-3-pyridinyl)-5-[4-(phenylmethyl)phenoxy]pentanoic acid ethyl ester IUPAC Name: ethyl 3-(2-aminopyridin-3-yl)-5-(4-benzylphenoxy)pentanoate Traditional Name: 3-(2-amino-3-pyridyl)-5-(4-benzylphenoxy)valeric acid ethyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CCOC1=CC=C(C=C1)CC2=CC=CC=C2)C3=C(N=CC=C3)N

Isomeric SMILES

CCOC(=O)CC(CCOC1=CC=C(C=C1)CC2=CC=CC=C2)C3=C(N=CC=C3)N

InChI

InChI=1S/C25H28N2O3/c1-2-29-24(28)18-21(23-9-6-15-27-25(23)26)14-16-30-22-12-10-20(11-13-22)17-19-7-4-3-5-8-19/h3-13,15,21H,2,14,16-18H2,1H3,(H2,26,27)