ethyl 5-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(4-chloro-2-methylphenoxy)butanoylamino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C23H24ClN3O4 MolecularWeight: 441.90736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C23H24ClN3O4/c1-3-30-23(29)19-15-25-27(18-8-5-4-6-9-18)22(19)26-21(28)10-7-13-31-20-12-11-17(24)14-16(20)2/h4-6,8-9,11-12,14-15H,3,7,10,13H2,1-2H3,(H,26,28)