methyl 3-[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]-4-morpholin-4-yl-benzoate

Systemtic Name: methyl 3-[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]-4-morpholin-4-yl-benzoate Openeye Name: methyl 3-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]-4-morpholino-benzoate CAS Name: 3-[[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]amino]-4-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]-4-morpholin-4-ylbenzoate Traditional Name: 3-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]-4-morpholino-benzoic acid methyl ester Formula: C21H23ClN2O5 MolecularWeight: 418.87072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCOCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCOCC3)Cl

InChI

InChI=1S/C21H23ClN2O5/c1-14-11-16(4-5-17(14)22)29-13-20(25)23-18-12-15(21(26)27-2)3-6-19(18)24-7-9-28-10-8-24/h3-6,11-12H,7-10,13H2,1-2H3,(H,23,25)