[4-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]-2-methoxy-phenyl] 2-(2-prop-2-enylphenoxy)ethanoate

Systemtic Name: [4-[(E)-2-cyano-3-oxidanylidene-3-(propan-2-ylamino)prop-1-enyl]-2-methoxy-phenyl] 2-(2-prop-2-enylphenoxy)ethanoate Openeye Name: [4-[(E)-2-cyano-3-(isopropylamino)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 2-(2-allylphenoxy)acetate CAS Name: 2-(2-prop-2-enylphenoxy)acetic acid [4-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-oxo-3-(propan-2-ylamino)prop-1-enyl]-2-methoxyphenyl] 2-(2-prop-2-enylphenoxy)acetate Traditional Name: 2-(2-allylphenoxy)acetic acid [4-[(E)-2-cyano-3-(isopropylamino)-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC(=C(C=C1)OC(=O)COC2=CC=CC=C2CC=C)OC)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CC(=C(C=C1)OC(=O)COC2=CC=CC=C2CC=C)OC)/C#N

InChI

InChI=1S/C25H26N2O5/c1-5-8-19-9-6-7-10-21(19)31-16-24(28)32-22-12-11-18(14-23(22)30-4)13-20(15-26)25(29)27-17(2)3/h5-7,9-14,17H,1,8,16H2,2-4H3,(H,27,29)/b20-13+