methyl 3-[2-[4-(4-chlorophenyl)-4-oxidanylidene-butanoyl]oxyethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[4-(4-chlorophenyl)-4-oxidanylidene-butanoyl]oxyethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[4-(4-chlorophenyl)-4-oxo-butanoyl]oxyacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[4-(4-chlorophenyl)-1,4-dioxobutoxy]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[4-(4-chlorophenyl)-4-oxobutanoyl]oxyacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[4-(4-chlorophenyl)-4-keto-butanoyl]oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H20ClNO6 MolecularWeight: 417.8396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H20ClNO6/c1-13-3-4-15(21(27)28-2)11-17(13)23-19(25)12-29-20(26)10-9-18(24)14-5-7-16(22)8-6-14/h3-8,11H,9-10,12H2,1-2H3,(H,23,25)