ethyl 2-[[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]methyl]-3-phosphonooxy-propanoate

Systemtic Name: ethyl 2-[[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]methyl]-3-phosphonooxy-propanoate Openeye Name: ethyl 2-[[6-(tert-butoxycarbonylamino)-3-pyridyl]methyl]-3-phosphonooxy-propanoate CAS Name: 2-[[6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pyridinyl]methyl]-3-phosphonooxypropanoic acid ethyl ester IUPAC Name: ethyl 2-[[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]methyl]-3-phosphonooxypropanoate Traditional Name: 2-[[6-(tert-butoxycarbonylamino)-3-pyridyl]methyl]-3-phosphonooxy-propionic acid ethyl ester Formula: C16H25N2O8P MolecularWeight: 404.352061

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CN=C(C=C1)NC(=O)OC(C)(C)C)COP(=O)(O)O

Isomeric SMILES

CCOC(=O)C(CC1=CN=C(C=C1)NC(=O)OC(C)(C)C)COP(=O)(O)O

InChI

InChI=1S/C16H25N2O8P/c1-5-24-14(19)12(10-25-27(21,22)23)8-11-6-7-13(17-9-11)18-15(20)26-16(2,3)4/h6-7,9,12H,5,8,10H2,1-4H3,(H,17,18,20)(H2,21,22,23)