butyl 4-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(1-butyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]benzoate CAS Name: 4-[[(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(1-butyl-5-chloro-3-methylpyrazole-4-carbonyl)amino]benzoate Traditional Name: 4-[(1-butyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]benzoic acid butyl ester Formula: C20H26ClN3O3 MolecularWeight: 391.89174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)NC2=CC=C(C=C2)C(=O)OCCCC)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)NC2=CC=C(C=C2)C(=O)OCCCC)Cl

InChI

InChI=1S/C20H26ClN3O3/c1-4-6-12-24-18(21)17(14(3)23-24)19(25)22-16-10-8-15(9-11-16)20(26)27-13-7-5-2/h8-11H,4-7,12-13H2,1-3H3,(H,22,25)