butyl 3-[4-(4-chloranyl-3-methyl-phenoxy)butanoylamino]benzoate

Systemtic Name: butyl 3-[4-(4-chloranyl-3-methyl-phenoxy)butanoylamino]benzoate Openeye Name: butyl 3-[4-(4-chloro-3-methyl-phenoxy)butanoylamino]benzoate CAS Name: 3-[[4-(4-chloro-3-methylphenoxy)-1-oxobutyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[4-(4-chloro-3-methylphenoxy)butanoylamino]benzoate Traditional Name: 3-[4-(4-chloro-3-methyl-phenoxy)butanoylamino]benzoic acid butyl ester Formula: C22H26ClNO4 MolecularWeight: 403.89914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CCCOC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CCCOC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C22H26ClNO4/c1-3-4-12-28-22(26)17-7-5-8-18(15-17)24-21(25)9-6-13-27-19-10-11-20(23)16(2)14-19/h5,7-8,10-11,14-15H,3-4,6,9,12-13H2,1-2H3,(H,24,25)