[2-oxidanylidene-2-(4-propylphenyl)ethyl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(4-propylphenyl)ethyl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Openeye Name: [2-oxo-2-(4-propylphenyl)ethyl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-(1,3,5-trimethyl-4-pyrazolyl)-2-propenoic acid [2-oxo-2-(4-propylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-propylphenyl)ethyl] (E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1,3,5-trimethylpyrazol-4-yl)acrylic acid [2-keto-2-(4-propylphenyl)ethyl] ester Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)COC(=O)C=CC2=C(N(N=C2C)C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)COC(=O)/C=C/C2=C(N(N=C2C)C)C

InChI

InChI=1S/C20H24N2O3/c1-5-6-16-7-9-17(10-8-16)19(23)13-25-20(24)12-11-18-14(2)21-22(4)15(18)3/h7-12H,5-6,13H2,1-4H3/b12-11+