methyl 4-diethoxyphosphoryl-2,4-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pyrrole-3-carboxylate

Systemtic Name: methyl 4-diethoxyphosphoryl-2,4-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pyrrole-3-carboxylate Openeye Name: methyl 1-(tert-butoxycarbonylamino)-4-diethoxyphosphoryl-2,4-dimethyl-5-oxo-pyrrole-3-carboxylate CAS Name: 4-diethoxyphosphoryl-2,4-dimethyl-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxo-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-diethoxyphosphoryl-2,4-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopyrrole-3-carboxylate Traditional Name: 1-(tert-butoxycarbonylamino)-4-diethoxyphosphoryl-5-keto-2,4-dimethyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C17H29N2O8P MolecularWeight: 420.394521

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1(C(=C(N(C1=O)NC(=O)OC(C)(C)C)C)C(=O)OC)C)OCC

Isomeric SMILES

CCOP(=O)(C1(C(=C(N(C1=O)NC(=O)OC(C)(C)C)C)C(=O)OC)C)OCC

InChI

InChI=1S/C17H29N2O8P/c1-9-25-28(23,26-10-2)17(7)12(13(20)24-8)11(3)19(14(17)21)18-15(22)27-16(4,5)6/h9-10H2,1-8H3,(H,18,22)