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

Systemtic Name: 1,3-benzodioxol-5-yl (E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]prop-2-enoate Openeye Name: 1,3-benzodioxol-5-yl (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 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (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 1,3-benzodioxol-5-yl ester Formula: C18H19ClN2O4 MolecularWeight: 362.80746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OC2=CC3=C(C=C2)OCO3)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)OC2=CC3=C(C=C2)OCO3)Cl)CC(C)C

InChI

InChI=1S/C18H19ClN2O4/c1-11(2)9-21-18(19)14(12(3)20-21)5-7-17(22)25-13-4-6-15-16(8-13)24-10-23-15/h4-8,11H,9-10H2,1-3H3/b7-5+