(E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(2-methoxy-5-nitro-phenyl)prop-2-enamide

Systemtic Name: (E)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(2-methoxy-5-nitro-phenyl)prop-2-enamide Openeye Name: (E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-nitro-phenyl)prop-2-enamide CAS Name: (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-N-(2-methoxy-5-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-N-(2-methoxy-5-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-N-(2-methoxy-5-nitro-phenyl)acrylamide Formula: C18H21ClN4O4 MolecularWeight: 392.83674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)Cl)CC(C)C

InChI

InChI=1S/C18H21ClN4O4/c1-11(2)10-22-18(19)14(12(3)21-22)6-8-17(24)20-15-9-13(23(25)26)5-7-16(15)27-4/h5-9,11H,10H2,1-4H3,(H,20,24)/b8-6+