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

Systemtic Name: ethyl 2-diethoxyphosphoryl-3-[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]propanoate Openeye Name: ethyl 3-[6-(tert-butoxycarbonylamino)-3-pyridyl]-2-diethoxyphosphoryl-propanoate CAS Name: 2-diethoxyphosphoryl-3-[6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pyridinyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-diethoxyphosphoryl-3-[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]propanoate Traditional Name: 3-[6-(tert-butoxycarbonylamino)-3-pyridyl]-2-diethoxyphosphoryl-propionic acid ethyl ester Formula: C19H31N2O7P MolecularWeight: 430.432401

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CN=C(C=C1)NC(=O)OC(C)(C)C)P(=O)(OCC)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CN=C(C=C1)NC(=O)OC(C)(C)C)P(=O)(OCC)OCC

InChI

InChI=1S/C19H31N2O7P/c1-7-25-17(22)15(29(24,26-8-2)27-9-3)12-14-10-11-16(20-13-14)21-18(23)28-19(4,5)6/h10-11,13,15H,7-9,12H2,1-6H3,(H,20,21,23)