tert-butyl [4-[(E)-2-cyano-3-oxidanylidene-3-(phenethylamino)prop-1-enyl]-2-methoxy-phenyl] carbonate

Systemtic Name: tert-butyl [4-[(E)-2-cyano-3-oxidanylidene-3-(phenethylamino)prop-1-enyl]-2-methoxy-phenyl] carbonate Openeye Name: tert-butyl [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxy-phenyl] carbonate CAS Name: carbonic acid tert-butyl [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: tert-butyl [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] carbonate Traditional Name: carbonic acid tert-butyl [4-[(E)-2-cyano-3-keto-3-(phenethylamino)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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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)NCCC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)OC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NCCC2=CC=CC=C2)OC

InChI

InChI=1S/C24H26N2O5/c1-24(2,3)31-23(28)30-20-11-10-18(15-21(20)29-4)14-19(16-25)22(27)26-13-12-17-8-6-5-7-9-17/h5-11,14-15H,12-13H2,1-4H3,(H,26,27)/b19-14+