methyl 4-chloranyl-3-[2-[methylsulfonyl-(4-morpholin-4-ylcarbonylphenyl)amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[2-[methylsulfonyl-(4-morpholin-4-ylcarbonylphenyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4-chloro-3-[[2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetyl]amino]benzoate CAS Name: 4-chloro-3-[[2-[N-methylsulfonyl-4-[4-morpholinyl(oxo)methyl]anilino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetyl]amino]benzoate Traditional Name: 4-chloro-3-[[2-[N-mesyl-4-(morpholine-4-carbonyl)anilino]acetyl]amino]benzoic acid methyl ester Formula: C22H24ClN3O7S MolecularWeight: 509.95986

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CN(C2=CC=C(C=C2)C(=O)N3CCOCC3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CN(C2=CC=C(C=C2)C(=O)N3CCOCC3)S(=O)(=O)C

InChI

InChI=1S/C22H24ClN3O7S/c1-32-22(29)16-5-8-18(23)19(13-16)24-20(27)14-26(34(2,30)31)17-6-3-15(4-7-17)21(28)25-9-11-33-12-10-25/h3-8,13H,9-12,14H2,1-2H3,(H,24,27)