(2,5-dimethoxyphenyl)methyl (E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: (2,5-dimethoxyphenyl)methyl (E)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate Openeye Name: (2,5-dimethoxyphenyl)methyl (E)-3-(1-benzylpyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenoic acid (2,5-dimethoxyphenyl)methyl ester IUPAC Name: (2,5-dimethoxyphenyl)methyl (E)-3-(1-benzylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)acrylic acid (2,5-dimethoxybenzyl) ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)COC(=O)C=CC2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)COC(=O)/C=C/C2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C22H22N2O4/c1-26-20-9-10-21(27-2)19(12-20)16-28-22(25)11-8-18-13-23-24(15-18)14-17-6-4-3-5-7-17/h3-13,15H,14,16H2,1-2H3/b11-8+