ethyl 2-(1,3-benzodioxol-5-yl)-2-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]-2-propyl-phenoxy]ethanoate

Systemtic Name: ethyl 2-(1,3-benzodioxol-5-yl)-2-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]-2-propyl-phenoxy]ethanoate Openeye Name: ethyl 2-(1,3-benzodioxol-5-yl)-2-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]-2-propyl-phenoxy]acetate CAS Name: 2-(1,3-benzodioxol-5-yl)-2-[4-[(2-ethyl-5,7-dimethyl-3-imidazo[4,5-b]pyridinyl)methyl]-2-propylphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzodioxol-5-yl)-2-[4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]-2-propylphenoxy]acetate Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-[4-[(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-yl)methyl]-2-propyl-phenoxy]acetic acid ethyl ester Formula: C31H35N3O5 MolecularWeight: 529.6267

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)CN2C(=NC3=C2N=C(C=C3C)C)CC)OC(C4=CC5=C(C=C4)OCO5)C(=O)OCC

Isomeric SMILES

CCCC1=C(C=CC(=C1)CN2C(=NC3=C2N=C(C=C3C)C)CC)OC(C4=CC5=C(C=C4)OCO5)C(=O)OCC

InChI

InChI=1S/C31H35N3O5/c1-6-9-22-15-21(17-34-27(7-2)33-28-19(4)14-20(5)32-30(28)34)10-12-24(22)39-29(31(35)36-8-3)23-11-13-25-26(16-23)38-18-37-25/h10-16,29H,6-9,17-18H2,1-5H3