methyl 2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[4-(4-chloranyl-2-methyl-phenoxy)butanoylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-4,5-dimethoxy-benzoate CAS Name: 2-[[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[4-(4-chloro-2-methylphenoxy)butanoylamino]-4,5-dimethoxybenzoate Traditional Name: 2-[4-(4-chloro-2-methyl-phenoxy)butanoylamino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C21H24ClNO6 MolecularWeight: 421.87136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC

InChI

InChI=1S/C21H24ClNO6/c1-13-10-14(22)7-8-17(13)29-9-5-6-20(24)23-16-12-19(27-3)18(26-2)11-15(16)21(25)28-4/h7-8,10-12H,5-6,9H2,1-4H3,(H,23,24)