methyl 4-[[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]methyl]benzoate Openeye Name: methyl 4-[[4-(4-chloro-2-methyl-phenoxy)butanoylamino]methyl]benzoate CAS Name: 4-[[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(4-chloro-2-methylphenoxy)butanoylamino]methyl]benzoate Traditional Name: 4-[[4-(4-chloro-2-methyl-phenoxy)butanoylamino]methyl]benzoic acid methyl ester Formula: C20H22ClNO4 MolecularWeight: 375.84598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H22ClNO4/c1-14-12-17(21)9-10-18(14)26-11-3-4-19(23)22-13-15-5-7-16(8-6-15)20(24)25-2/h5-10,12H,3-4,11,13H2,1-2H3,(H,22,23)