tert-butyl N-[1-[[5-chloranyl-2-(2-methylpropoxy)phenyl]methyl]-5-methyl-pyrazol-3-yl]carbamate

Systemtic Name: tert-butyl N-[1-[[5-chloranyl-2-(2-methylpropoxy)phenyl]methyl]-5-methyl-pyrazol-3-yl]carbamate Openeye Name: tert-butyl N-[1-[(5-chloro-2-isobutoxy-phenyl)methyl]-5-methyl-pyrazol-3-yl]carbamate CAS Name: N-[1-[[5-chloro-2-(2-methylpropoxy)phenyl]methyl]-5-methyl-3-pyrazolyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[[5-chloro-2-(2-methylpropoxy)phenyl]methyl]-5-methylpyrazol-3-yl]carbamate Traditional Name: N-[1-(5-chloro-2-isobutoxy-benzyl)-5-methyl-pyrazol-3-yl]carbamic acid tert-butyl ester Formula: C20H28ClN3O3 MolecularWeight: 393.90762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=C(C=CC(=C2)Cl)OCC(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=NN1CC2=C(C=CC(=C2)Cl)OCC(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H28ClN3O3/c1-13(2)12-26-17-8-7-16(21)10-15(17)11-24-14(3)9-18(23-24)22-19(25)27-20(4,5)6/h7-10,13H,11-12H2,1-6H3,(H,22,23,25)