(4-acetamidophenyl) (E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: (4-acetamidophenyl) (E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-enoate Openeye Name: (4-acetamidophenyl) (E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-2-propenoic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)acrylic acid (4-acetamidophenyl) ester Formula: C19H22ClN3O3 MolecularWeight: 375.84928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OC2=CC=C(C=C2)NC(=O)C)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)OC2=CC=C(C=C2)NC(=O)C)Cl)CC(C)C

InChI

InChI=1S/C19H22ClN3O3/c1-12(2)11-23-19(20)17(13(3)22-23)9-10-18(25)26-16-7-5-15(6-8-16)21-14(4)24/h5-10,12H,11H2,1-4H3,(H,21,24)/b10-9+