methyl 2-[4-(3H-imidazo[4,5-c]pyridin-2-yl)-3-prop-2-ynoxy-phenoxy]ethanoate

Systemtic Name: methyl 2-[4-(3H-imidazo[4,5-c]pyridin-2-yl)-3-prop-2-ynoxy-phenoxy]ethanoate Openeye Name: methyl 2-[4-(3H-imidazo[4,5-c]pyridin-2-yl)-3-prop-2-ynoxy-phenoxy]acetate CAS Name: 2-[4-(3H-imidazo[4,5-c]pyridin-2-yl)-3-prop-2-ynoxyphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3H-imidazo[4,5-c]pyridin-2-yl)-3-prop-2-ynoxyphenoxy]acetate Traditional Name: 2-[4-(3H-imidazo[4,5-c]pyridin-2-yl)-3-propargyloxy-phenoxy]acetic acid methyl ester Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC(=C(C=C1)C2=NC3=C(N2)C=NC=C3)OCC#C

Isomeric SMILES

COC(=O)COC1=CC(=C(C=C1)C2=NC3=C(N2)C=NC=C3)OCC#C

InChI

InChI=1S/C18H15N3O4/c1-3-8-24-16-9-12(25-11-17(22)23-2)4-5-13(16)18-20-14-6-7-19-10-15(14)21-18/h1,4-7,9-10H,8,11H2,2H3,(H,20,21)