[2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: [2-(2-methoxyphenyl)-2-oxidanylidene-ethyl] 3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate Openeye Name: [2-(2-methoxyphenyl)-2-oxo-ethyl] 3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enoate CAS Name: 3-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-2-propenoic acid [2-(2-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyphenyl)-2-oxoethyl] 3-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enoate Traditional Name: 3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)acrylic acid [2-keto-2-(2-methoxyphenyl)ethyl] ester Formula: C23H21ClN2O4 MolecularWeight: 424.87684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OCC(=O)C2=CC=CC=C2OC)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)OCC(=O)C2=CC=CC=C2OC)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C23H21ClN2O4/c1-16-18(23(24)26(25-16)14-17-8-4-3-5-9-17)12-13-22(28)30-15-20(27)19-10-6-7-11-21(19)29-2/h3-13H,14-15H2,1-2H3