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

Systemtic Name: ethyl 3-[2-[methylsulfonyl-(4-morpholin-4-ylcarbonylphenyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetyl]amino]benzoate CAS Name: 3-[[2-[N-methylsulfonyl-4-[4-morpholinyl(oxo)methyl]anilino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[N-methylsulfonyl-4-(morpholine-4-carbonyl)anilino]acetyl]amino]benzoate Traditional Name: 3-[[2-[N-mesyl-4-(morpholine-4-carbonyl)anilino]acetyl]amino]benzoic acid ethyl ester Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O7S/c1-3-33-23(29)18-5-4-6-19(15-18)24-21(27)16-26(34(2,30)31)20-9-7-17(8-10-20)22(28)25-11-13-32-14-12-25/h4-10,15H,3,11-14,16H2,1-2H3,(H,24,27)