ethyl 5-methyl-3-[(E)-2-phenylethenyl]-1-(phenylmethyl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-3-[(E)-2-phenylethenyl]-1-(phenylmethyl)pyrazole-4-carboxylate Openeye Name: ethyl 1-benzyl-5-methyl-3-[(E)-styryl]pyrazole-4-carboxylate CAS Name: 5-methyl-3-[(E)-2-phenylethenyl]-1-(phenylmethyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-5-methyl-3-[(E)-2-phenylethenyl]pyrazole-4-carboxylate Traditional Name: 1-benzyl-5-methyl-3-[(E)-styryl]pyrazole-4-carboxylic acid ethyl ester Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C=CC2=CC=CC=C2)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1/C=C/C2=CC=CC=C2)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H22N2O2/c1-3-26-22(25)21-17(2)24(16-19-12-8-5-9-13-19)23-20(21)15-14-18-10-6-4-7-11-18/h4-15H,3,16H2,1-2H3/b15-14+