tert-butyl [4-[(E)-2-cyano-3-oxidanylidene-3-[[(2R)-oxolan-2-yl]methylamino]prop-1-enyl]-2-methoxy-phenyl] carbonate

Systemtic Name: tert-butyl [4-[(E)-2-cyano-3-oxidanylidene-3-[[(2R)-oxolan-2-yl]methylamino]prop-1-enyl]-2-methoxy-phenyl] carbonate Openeye Name: tert-butyl [4-[(E)-2-cyano-3-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methylamino]prop-1-enyl]-2-methoxy-phenyl] carbonate CAS Name: carbonic acid tert-butyl [4-[(E)-2-cyano-3-oxo-3-[[(2R)-2-oxolanyl]methylamino]prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: tert-butyl [4-[(E)-2-cyano-3-oxo-3-[[(2R)-oxolan-2-yl]methylamino]prop-1-enyl]-2-methoxyphenyl] carbonate Traditional Name: carbonic acid tert-butyl [4-[(E)-2-cyano-3-keto-3-[[(2R)-tetrahydrofuran-2-yl]methylamino]prop-1-enyl]-2-methoxy-phenyl] ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=C(C=C(C=C1)C=C(C#N)C(=O)NCC2CCCO2)OC

Isomeric SMILES

CC(C)(C)OC(=O)OC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC[C@H]2CCCO2)OC

InChI

InChI=1S/C21H26N2O6/c1-21(2,3)29-20(25)28-17-8-7-14(11-18(17)26-4)10-15(12-22)19(24)23-13-16-6-5-9-27-16/h7-8,10-11,16H,5-6,9,13H2,1-4H3,(H,23,24)/b15-10+/t16-/m1/s1