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

Systemtic Name: tert-butyl [4-[(E)-2-cyano-3-oxidanylidene-3-(4-propylphenyl)prop-1-enyl]-2-methoxy-phenyl] carbonate Openeye Name: tert-butyl [4-[(E)-2-cyano-3-oxo-3-(4-propylphenyl)prop-1-enyl]-2-methoxy-phenyl] carbonate CAS Name: carbonic acid tert-butyl [4-[(E)-2-cyano-3-oxo-3-(4-propylphenyl)prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: tert-butyl [4-[(E)-2-cyano-3-oxo-3-(4-propylphenyl)prop-1-enyl]-2-methoxyphenyl] carbonate Traditional Name: carbonic acid tert-butyl [4-[(E)-2-cyano-3-keto-3-(4-propylphenyl)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)C(=CC2=CC(=C(C=C2)OC(=O)OC(C)(C)C)OC)C#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)/C(=C/C2=CC(=C(C=C2)OC(=O)OC(C)(C)C)OC)/C#N

InChI

InChI=1S/C25H27NO5/c1-6-7-17-8-11-19(12-9-17)23(27)20(16-26)14-18-10-13-21(22(15-18)29-5)30-24(28)31-25(2,3)4/h8-15H,6-7H2,1-5H3/b20-14+