5-chloranyl-N'-(4-hexoxyphenyl)carbonyl-3-methyl-1-(2-methylpropyl)pyrazole-4-carbohydrazide

Systemtic Name: 5-chloranyl-N'-(4-hexoxyphenyl)carbonyl-3-methyl-1-(2-methylpropyl)pyrazole-4-carbohydrazide Openeye Name: 5-chloro-N'-(4-hexoxybenzoyl)-1-isobutyl-3-methyl-pyrazole-4-carbohydrazide CAS Name: 5-chloro-N'-[(4-hexoxyphenyl)-oxomethyl]-3-methyl-1-(2-methylpropyl)-4-pyrazolecarbohydrazide IUPAC Name: 5-chloro-N'-(4-hexoxybenzoyl)-3-methyl-1-(2-methylpropyl)pyrazole-4-carbohydrazide Traditional Name: 5-chloro-N'-(4-hexoxybenzoyl)-1-isobutyl-3-methyl-pyrazole-4-carbohydrazide Formula: C22H31ClN4O3 MolecularWeight: 434.95954

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=C(N(N=C2C)CC(C)C)Cl

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=O)C2=C(N(N=C2C)CC(C)C)Cl

InChI

InChI=1S/C22H31ClN4O3/c1-5-6-7-8-13-30-18-11-9-17(10-12-18)21(28)24-25-22(29)19-16(4)26-27(20(19)23)14-15(2)3/h9-12,15H,5-8,13-14H2,1-4H3,(H,24,28)(H,25,29)